N,N-bis(cyanomethyl)biphenyl-4-carboxamide
TL;DR: N,N-bis(cyanomethyl)biphenyl-4-carboxamide (CAS 333350-75-7) is a chemical compound with molecular formula C17H13N3O and molecular weight 275.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(cyanomethyl)-4-phenylbenzamide
Also Known As: N,N-bis(cyanomethyl)-4-phenylbenzamide, N,N-bis(cyanomethyl)biphenyl-4-carboxamide, N,N-bis(cyanomethyl)(4-phenylphenyl)carboxamide, N,N-BIS(CYANOMETHYL)-[1,1'-BIPHENYL]-4-CARBOXAMIDE
| Molecular Formula | C17H13N3O |
|---|---|
| Molecular Weight | 275.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.10587 |
| Heavy Atoms | 21 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 333350-75-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N(CC#N)CC#N |
| InChIKey | IGVQXMLVFDKHLQ-UHFFFAOYSA-N |
Product Overview
N,N-bis(cyanomethyl)biphenyl-4-carboxamide (CAS 333350-75-7), with molecular formula C17H13N3O and molecular weight 275.11 g/mol. IUPAC: N,N-bis(cyanomethyl)-4-phenylbenzamide.
Chemical Property Profile of N,N-bis(cyanomethyl)biphenyl-4-carboxamide
Property Insights of N,N-bis(cyanomethyl)biphenyl-4-carboxamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-bis(cyanomethyl)biphenyl-4-carboxamide. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-bis(cyanomethyl)biphenyl-4-carboxamide. Following Lipinski's Rule of Five, N,N-bis(cyanomethyl)biphenyl-4-carboxamide has 0 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 N,N-bis(cyanomethyl)biphenyl-4-carboxamide?
The CAS number of N,N-bis(cyanomethyl)biphenyl-4-carboxamide is 333350-75-7.
What is the molecular formula of N,N-bis(cyanomethyl)biphenyl-4-carboxamide?
The molecular formula of N,N-bis(cyanomethyl)biphenyl-4-carboxamide is C17H13N3O.
What is the molecular weight of N,N-bis(cyanomethyl)biphenyl-4-carboxamide?
The molecular weight of N,N-bis(cyanomethyl)biphenyl-4-carboxamide is 275.11 g/mol.
Where can I buy N,N-bis(cyanomethyl)biphenyl-4-carboxamide?
You can request a quote for N,N-bis(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,N-bis(cyanomethyl)biphenyl-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(cyanomethyl)biphenyl-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.