N-(2,2-dichloro-1-cyanoethenyl)benzamide
TL;DR: N-(2,2-dichloro-1-cyanoethenyl)benzamide (CAS 49837-70-9) is a chemical compound with molecular formula C10H6Cl2N2O and molecular weight 239.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,2-dichloro-1-cyanoethenyl)benzamide
Also Known As: N-(2,2-dichloro-1-cyanoethenyl)benzamide, N-(2,2-dichloro-1-cyano-vinyl)-benzamide, N-(2,2-dichloro-1-cyanoeth-1-en-1-yl)benzamide, N-(2,2-dichloro-1-cyanovinyl)benzamide, 2-benzoylamino-3,3-dichloroacrylonitrile
| Molecular Formula | C10H6Cl2N2O |
|---|---|
| Molecular Weight | 239.99 g/mol |
| LogP | 2.58668 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.98572 |
| Heavy Atoms | 15 |
| Complexity | 430.48566 |
Chemical Identifiers
| CAS Number | 49837-70-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=C(Cl)Cl)C#N |
Product Overview
N-(2,2-dichloro-1-cyanoethenyl)benzamide (CAS 49837-70-9), with molecular formula C10H6Cl2N2O and molecular weight 239.99 g/mol. IUPAC: N-(2,2-dichloro-1-cyanoethenyl)benzamide.
Chemical Property Profile of N-(2,2-dichloro-1-cyanoethenyl)benzamide
Property Insights of N-(2,2-dichloro-1-cyanoethenyl)benzamide
The XLogP value of 2.58668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,2-dichloro-1-cyanoethenyl)benzamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(2,2-dichloro-1-cyanoethenyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,2-dichloro-1-cyanoethenyl)benzamide 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-(2,2-dichloro-1-cyanoethenyl)benzamide?
The CAS number of N-(2,2-dichloro-1-cyanoethenyl)benzamide is 49837-70-9.
What is the molecular formula of N-(2,2-dichloro-1-cyanoethenyl)benzamide?
The molecular formula of N-(2,2-dichloro-1-cyanoethenyl)benzamide is C10H6Cl2N2O.
What is the molecular weight of N-(2,2-dichloro-1-cyanoethenyl)benzamide?
The molecular weight of N-(2,2-dichloro-1-cyanoethenyl)benzamide is 239.99 g/mol.
Where can I buy N-(2,2-dichloro-1-cyanoethenyl)benzamide?
You can request a quote for N-(2,2-dichloro-1-cyanoethenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2-dichloro-1-cyanoethenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2-dichloro-1-cyanoethenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.