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RefChem:1096226 structure
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RefChem:1096226

TL;DR: RefChem:1096226 (CAS 15676-58-1) is a chemical compound with molecular formula C25H29NO5 and molecular weight 423.20456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(Z)-but-2-enedioic acid;1-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)piperidine

Also Known As: 3-((10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-methylpiperidine maleate, Piperidine, 3-((10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-1-methyl-, maleate (1:1)

CAS Number
15676-58-1
Molecular Formula
C25H29NO5
Molecular Weight
423.20456 g/mol
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Technical Specifications

Molecular FormulaC25H29NO5
Molecular Weight423.20456 g/mol
XLogP3.6972
Topological Polar Surface Area (TPSA)87.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass423.20456 Da
Heavy Atoms31
Complexity479.0
SMILESCN1CCCC(C1)OC2C3=CC=CC=C3CCC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O
InChIKeyDKRPEPQULPOWBX-BTJKTKAUSA-N

Chemical Property Profile of RefChem:1096226

XLogP
3.6972
TPSA (Topological Polar Surface Area)
87.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
31
Complexity
479.0
Exact Mass
423.20456
Monoisotopic Mass
423.20456
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 RefChem:1096226

The XLogP value of 3.6972 indicates that RefChem:1096226 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1096226. Following Lipinski's Rule of Five, RefChem:1096226 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:1096226?

The CAS number of RefChem:1096226 is 15676-58-1.

What is the molecular formula of RefChem:1096226?

The molecular formula of RefChem:1096226 is C25H29NO5.

What is the molecular weight of RefChem:1096226?

The molecular weight of RefChem:1096226 is 423.20456 g/mol.

Where can I buy RefChem:1096226?

You can request a quote for RefChem:1096226 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1096226?

Yes, CoreyChem provides custom synthesis services for RefChem:1096226 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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