N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide
TL;DR: N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide (CAS 340313-80-6) is a chemical compound with molecular formula C17H12Cl2N2O and molecular weight 330.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide
Also Known As: N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide
| Molecular Formula | C17H12Cl2N2O |
|---|---|
| Molecular Weight | 330.03 g/mol |
| LogP | 4.21678 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.03265 |
| Heavy Atoms | 22 |
| Complexity | 748.9994 |
Chemical Identifiers
| CAS Number | 340313-80-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)C(=CC2=CC(=C(C=C2)Cl)Cl)C#N |
Product Overview
N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide (CAS 340313-80-6), with molecular formula C17H12Cl2N2O and molecular weight 330.03 g/mol. IUPAC: N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide.
Chemical Property Profile of N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide
Property Insights of N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide
The XLogP value of 4.21678 indicates that N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide 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-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide?
The CAS number of N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide is 340313-80-6.
What is the molecular formula of N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide?
The molecular formula of N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide is C17H12Cl2N2O.
What is the molecular weight of N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide?
The molecular weight of N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide is 330.03 g/mol.
Where can I buy N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide?
You can request a quote for N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2-cyano-3-(3,4-dichlorophenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.