2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide
TL;DR: 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide (CAS 333345-63-4) is a chemical compound with molecular formula C16H11Cl2N3O and molecular weight 331.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-3-(3,4-dichlorophenyl)-N-(pyridin-3-ylmethyl)prop-2-enamide
Also Known As: 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide, 2-cyano-3-(3,4-dichlorophenyl)-N-(pyridin-3-ylmethyl)prop-2-enamide, 2-Cyano-3-(3,4-dichlorophenyl)-N-[(pyridin-3-yl)methyl]prop-2-enamide
| Molecular Formula | C16H11Cl2N3O |
|---|---|
| Molecular Weight | 331.03 g/mol |
| LogP | 3.61178 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.02792 |
| Heavy Atoms | 22 |
| Complexity | 751.7314 |
Chemical Identifiers
| CAS Number | 333345-63-4 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC(=O)C(=CC2=CC(=C(C=C2)Cl)Cl)C#N |
Product Overview
2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide (CAS 333345-63-4), with molecular formula C16H11Cl2N3O and molecular weight 331.03 g/mol. IUPAC: 2-cyano-3-(3,4-dichlorophenyl)-N-(pyridin-3-ylmethyl)prop-2-enamide.
Chemical Property Profile of 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide
Property Insights of 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide
The XLogP value of 3.61178 indicates that 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide. Following Lipinski's Rule of Five, 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide has 1 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 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide?
The CAS number of 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide is 333345-63-4.
What is the molecular formula of 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide?
The molecular formula of 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide is C16H11Cl2N3O.
What is the molecular weight of 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide?
The molecular weight of 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide is 331.03 g/mol.
Where can I buy 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide?
You can request a quote for 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3-(3,4-dichlorophenyl)-N-(3-pyridinylmethyl)-2-propenamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.