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RefChem:1068613 structure
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RefChem:1068613

TL;DR: RefChem:1068613 (CAS 145071-67-6) is a chemical compound with molecular formula C15H19N3O4 and molecular weight 305.13754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridin-1-yl] N-(4-methoxyphenyl)carbamate

Also Known As: 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-((((4-methoxyphenyl)amino)carbonyl)oxy)-, 3-(O-methyloxime), (E)-, 1-[(4-Methoxyphenyl)carbamoyl]oxy-1,2,5,6-tetrahydropyridine-3-carbaldehyde O-methyl oxime, 5-[(methoxyimino)methyl]-1,2,3,6-tetrahydropyridin-1-yl N-(4-methoxyphenyl)carbamate, BRN 5826755

CAS Number
145071-67-6
Molecular Formula
C15H19N3O4
Molecular Weight
305.13754 g/mol
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Technical Specifications

Molecular FormulaC15H19N3O4
Molecular Weight305.13754 g/mol
XLogP2.2
Topological Polar Surface Area (TPSA)72.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass305.13754 Da
Heavy Atoms22
Complexity417.0
SMILESCOC1=CC=C(C=C1)NC(=O)ON2CCC=C(C2)/C=N/OC
InChIKeyXWLBFTXXNDXXST-MHWRWJLKSA-N

Chemical Property Profile of RefChem:1068613

XLogP
2.2
TPSA (Topological Polar Surface Area)
72.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
22
Complexity
417.0
Exact Mass
305.13754
Monoisotopic Mass
305.13754
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:1068613

The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068613. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1068613. Following Lipinski's Rule of Five, RefChem:1068613 has 1 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:1068613?

The CAS number of RefChem:1068613 is 145071-67-6.

What is the molecular formula of RefChem:1068613?

The molecular formula of RefChem:1068613 is C15H19N3O4.

What is the molecular weight of RefChem:1068613?

The molecular weight of RefChem:1068613 is 305.13754 g/mol.

Where can I buy RefChem:1068613?

You can request a quote for RefChem:1068613 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1068613?

Yes, CoreyChem provides custom synthesis services for RefChem:1068613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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