![2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide structure](/static/products/1164/1164541-40-5.webp)
2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide
TL;DR: 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide (CAS 1164541-40-5) is a chemical compound with molecular formula C20H18ClN3O3 and molecular weight 383.10 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-(2-methoxyethylamino)-3-oxoprop-1-enyl]phenyl]benzamide
Also Known As: 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide, 2-chloro-N-[3-[(E)-2-cyano-3-(2-methoxyethylamino)-3-oxoprop-1-enyl]phenyl]benzamide
| Molecular Formula | C20H18ClN3O3 |
|---|---|
| Molecular Weight | 383.10 g/mol |
| LogP | 3.26188 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.10367 |
| Heavy Atoms | 27 |
| Complexity | 903.3401 |
Chemical Identifiers
| CAS Number | 1164541-40-5 |
|---|---|
| SMILES | COCCNC(=O)/C(=C/C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2Cl)/C#N |
Product Overview
2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide (CAS 1164541-40-5), with molecular formula C20H18ClN3O3 and molecular weight 383.10 g/mol. IUPAC: 2-chloro-N-[3-[(E)-2-cyano-3-(2-methoxyethylamino)-3-oxoprop-1-enyl]phenyl]benzamide.
Chemical Property Profile of 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide
Property Insights of 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide
The XLogP value of 3.26188 indicates that 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)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-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide. Following Lipinski's Rule of Five, 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide has 2 hydrogen bond donor(s) and 4 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 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
The CAS number of 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide is 1164541-40-5.
What is the molecular formula of 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
The molecular formula of 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide is C20H18ClN3O3.
What is the molecular weight of 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
The molecular weight of 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide is 383.10 g/mol.
Where can I buy 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
You can request a quote for 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)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-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(3-{2-cyano-2-[(2-methoxyethyl)carbamoyl]eth-1-en-1-yl}phenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.