![2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide structure](/static/products/7317/731775-70-5.webp)
2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide
TL;DR: 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide (CAS 731775-70-5) is a chemical compound with molecular formula C29H20ClN3O3 and molecular weight 493.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[3-[(E)-2-cyano-3-oxo-3-(2-phenoxyanilino)prop-1-enyl]phenyl]benzamide
Also Known As: 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide, 2-chloro-N-[3-[(E)-2-cyano-3-oxo-3-(2-phenoxyanilino)prop-1-enyl]phenyl]benzamide, 2-chloro-N-[3-[2-cyano-2-[(2-phenoxyphenyl)carbamoyl]ethenyl]phenyl]benzamide
| Molecular Formula | C29H20ClN3O3 |
|---|---|
| Molecular Weight | 493.12 g/mol |
| LogP | 6.93028 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 493.11932 |
| Heavy Atoms | 36 |
| Complexity | 1476.6019 |
Chemical Identifiers
| CAS Number | 731775-70-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)/C(=C/C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4Cl)/C#N |
Product Overview
2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide (CAS 731775-70-5), with molecular formula C29H20ClN3O3 and molecular weight 493.12 g/mol. IUPAC: 2-chloro-N-[3-[(E)-2-cyano-3-oxo-3-(2-phenoxyanilino)prop-1-enyl]phenyl]benzamide.
Chemical Property Profile of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide
Property Insights of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide
The XLogP value of 6.93028 indicates that 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide. Following Lipinski's Rule of Five, 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
The CAS number of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide is 731775-70-5.
What is the molecular formula of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
The molecular formula of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide is C29H20ClN3O3.
What is the molecular weight of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
The molecular weight of 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide is 493.12 g/mol.
Where can I buy 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
You can request a quote for 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(3-{2-cyano-2-[(2-phenoxyphenyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.