3-cyano-N-(pyridin-4-ylmethyl)benzamide
TL;DR: 3-cyano-N-(pyridin-4-ylmethyl)benzamide (CAS 879183-98-9) is a chemical compound with molecular formula C14H11N3O and molecular weight 237.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyano-N-(pyridin-4-ylmethyl)benzamide
Also Known As: 3-cyano-N-(pyridin-4-ylmethyl)benzamide
| Molecular Formula | C14H11N3O |
|---|---|
| Molecular Weight | 237.09 g/mol |
| LogP | 1.88328 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.09021 |
| Heavy Atoms | 18 |
| Complexity | 587.48816 |
Chemical Identifiers
| CAS Number | 879183-98-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)NCC2=CC=NC=C2)C#N |
Product Overview
3-cyano-N-(pyridin-4-ylmethyl)benzamide (CAS 879183-98-9), with molecular formula C14H11N3O and molecular weight 237.09 g/mol. IUPAC: 3-cyano-N-(pyridin-4-ylmethyl)benzamide.
Chemical Property Profile of 3-cyano-N-(pyridin-4-ylmethyl)benzamide
Property Insights of 3-cyano-N-(pyridin-4-ylmethyl)benzamide
The XLogP value of 1.88328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-cyano-N-(pyridin-4-ylmethyl)benzamide. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-cyano-N-(pyridin-4-ylmethyl)benzamide. Following Lipinski's Rule of Five, 3-cyano-N-(pyridin-4-ylmethyl)benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-cyano-N-(pyridin-4-ylmethyl)benzamide?
The CAS number of 3-cyano-N-(pyridin-4-ylmethyl)benzamide is 879183-98-9.
What is the molecular formula of 3-cyano-N-(pyridin-4-ylmethyl)benzamide?
The molecular formula of 3-cyano-N-(pyridin-4-ylmethyl)benzamide is C14H11N3O.
What is the molecular weight of 3-cyano-N-(pyridin-4-ylmethyl)benzamide?
The molecular weight of 3-cyano-N-(pyridin-4-ylmethyl)benzamide is 237.09 g/mol.
Where can I buy 3-cyano-N-(pyridin-4-ylmethyl)benzamide?
You can request a quote for 3-cyano-N-(pyridin-4-ylmethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-cyano-N-(pyridin-4-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-cyano-N-(pyridin-4-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.