N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide
TL;DR: N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide (CAS 680213-92-7) is a chemical compound with molecular formula C14H12Cl2N2O and molecular weight 294.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(4-chlorophenyl)-N-ethylpyridine-3-carboxamide
Also Known As: N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide, 2-(4-isopropylphenoxy)acetohydrazide, 2-chloro-N-(4-chlorophenyl)-N-ethylpyridine-3-carboxamide
| Molecular Formula | C14H12Cl2N2O |
|---|---|
| Molecular Weight | 294.03 g/mol |
| LogP | 4.0551 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.03265 |
| Heavy Atoms | 19 |
| Complexity | 584.25476 |
Chemical Identifiers
| CAS Number | 680213-92-7 |
|---|---|
| SMILES | CCN(C1=CC=C(C=C1)Cl)C(=O)C2=C(N=CC=C2)Cl |
Product Overview
N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide (CAS 680213-92-7), with molecular formula C14H12Cl2N2O and molecular weight 294.03 g/mol. IUPAC: 2-chloro-N-(4-chlorophenyl)-N-ethylpyridine-3-carboxamide.
Chemical Property Profile of N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide
Property Insights of N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide
The XLogP value of 4.0551 indicates that N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.2 Ų, N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide has 0 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 N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide?
The CAS number of N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide is 680213-92-7.
What is the molecular formula of N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide?
The molecular formula of N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide is C14H12Cl2N2O.
What is the molecular weight of N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide?
The molecular weight of N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide is 294.03 g/mol.
Where can I buy N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide?
You can request a quote for N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N3-(4-chlorophenyl)-N3-ethyl-2-chloronicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.