N-(cyanomethyl)biphenyl-4-carboxamide
TL;DR: N-(cyanomethyl)biphenyl-4-carboxamide (CAS 333350-76-8) is a chemical compound with molecular formula C15H12N2O and molecular weight 236.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)-4-phenylbenzamide
Also Known As: TimTec1_003393, N-(cyanomethyl)-4-phenylbenzamide, N-(cyanomethyl)biphenyl-4-carboxamide, N-(cyanomethyl)(4-phenylphenyl)carboxamide, N-(Cyanomethyl)[1,1'-biphenyl]-4-carboxamide
| Molecular Formula | C15H12N2O |
|---|---|
| Molecular Weight | 236.09 g/mol |
| LogP | 2.60698 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.09496 |
| Heavy Atoms | 18 |
| Complexity | 567.6926 |
Chemical Identifiers
| CAS Number | 333350-76-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCC#N |
Product Overview
N-(cyanomethyl)biphenyl-4-carboxamide (CAS 333350-76-8), with molecular formula C15H12N2O and molecular weight 236.09 g/mol. IUPAC: N-(cyanomethyl)-4-phenylbenzamide.
Chemical Property Profile of N-(cyanomethyl)biphenyl-4-carboxamide
Property Insights of N-(cyanomethyl)biphenyl-4-carboxamide
The XLogP value of 2.60698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(cyanomethyl)biphenyl-4-carboxamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(cyanomethyl)biphenyl-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(cyanomethyl)biphenyl-4-carboxamide has 1 hydrogen bond donor(s) and 2 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 N-(cyanomethyl)biphenyl-4-carboxamide?
The CAS number of N-(cyanomethyl)biphenyl-4-carboxamide is 333350-76-8.
What is the molecular formula of N-(cyanomethyl)biphenyl-4-carboxamide?
The molecular formula of N-(cyanomethyl)biphenyl-4-carboxamide is C15H12N2O.
What is the molecular weight of N-(cyanomethyl)biphenyl-4-carboxamide?
The molecular weight of N-(cyanomethyl)biphenyl-4-carboxamide is 236.09 g/mol.
Where can I buy N-(cyanomethyl)biphenyl-4-carboxamide?
You can request a quote for N-(cyanomethyl)biphenyl-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(cyanomethyl)biphenyl-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyanomethyl)biphenyl-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.