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3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- structure
Fine Chemical

3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-

TL;DR: 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- (CAS 1040851-06-6) is a chemical compound with molecular formula C31H40Cl2N4O4 and molecular weight 602.2427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-N-cyclohexyl-6-N-(3,4-dichlorophenyl)-3-[3-(3-methylpiperidin-1-yl)propyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide

Also Known As: 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-

CAS Number
1040851-06-6
Molecular Formula
C31H40Cl2N4O4
Molecular Weight
602.2427 g/mol
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Technical Specifications

Molecular FormulaC31H40Cl2N4O4
Molecular Weight602.2427 g/mol
XLogP4.2
Topological Polar Surface Area (TPSA)91.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds8
Exact Mass602.2427 Da
Heavy Atoms41
Complexity1040.0
SMILESCC1CCCN(C1)CCCN2C(C34C=CC(O3)C(C4C2=O)C(=O)NC5=CC(=C(C=C5)Cl)Cl)C(=O)NC6CCCCC6
InChIKeyOPKIARUVKSAZPK-UHFFFAOYSA-N

Product Description

Applications: AC1N48BG is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1N48BG (CAS 1040851-06-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, AC1N48BG (CAS 1040851-06-6) has the molecular formula C31H40Cl2N4O4 and a molecular weight of 602.24 g/mol. It is also known as SR-01000546070-1 and 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-

XLogP
4.2
TPSA (Topological Polar Surface Area)
91.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
8
Heavy Atoms
41
Complexity
1040.0
Exact Mass
602.2427
Monoisotopic Mass
602.2427
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-

The XLogP value of 4.2 indicates that 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-. Following Lipinski's Rule of Five, 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-?

The CAS number of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- is 1040851-06-6.

What is the molecular formula of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-?

The molecular formula of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- is C31H40Cl2N4O4.

What is the molecular weight of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-?

The molecular weight of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- is 602.2427 g/mol.

What are the applications of 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-?

AC1N48BG is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies AC1N48BG (CAS 1040851-06-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS...

Where can I buy 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-?

You can request a quote for 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo-?

Yes, CoreyChem provides custom synthesis services for 3a,6-Epoxy-3aH-isoindole-3,7-dicarboxamide, N3-cyclohexyl-N7-(3,4-dichlorophenyl)-1,2,3,6,7,7a-hexahydro-2-[3-(3-methyl-1-piperidinyl)propyl]-1-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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