![[(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate structure](/static/products/3898/389810-75-7.webp)
[(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
TL;DR: [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate (CAS 389810-75-7) is a chemical compound with molecular formula C15H9Cl2N3O3 and molecular weight 349.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate
Also Known As: AB00719416-01, [(5-chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate, [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate
| Molecular Formula | C15H9Cl2N3O3 |
|---|---|
| Molecular Weight | 349.00 g/mol |
| LogP | 3.05558 |
| Topological Polar Surface Area | 92.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.0021 |
| Heavy Atoms | 23 |
| Complexity | 802.7944 |
Chemical Identifiers
| CAS Number | 389810-75-7 |
|---|---|
| SMILES | C1=CC(=C(N=C1)Cl)C(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)C#N |
Product Overview
[(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate (CAS 389810-75-7), with molecular formula C15H9Cl2N3O3 and molecular weight 349.00 g/mol. IUPAC: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
Property Insights of [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
The XLogP value of 3.05558 indicates that [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.08 Ų falls within the moderate polarity range, balancing permeability and solubility for [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate has 1 hydrogen bond donor(s) and 5 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 [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
The CAS number of [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate is 389810-75-7.
What is the molecular formula of [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
The molecular formula of [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate is C15H9Cl2N3O3.
What is the molecular weight of [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
The molecular weight of [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate is 349.00 g/mol.
Where can I buy [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
You can request a quote for [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(5-Chloro-2-cyanophenyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.