![[(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate structure](/static/products/848/848321-15-3.png)
[(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
TL;DR: [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate (CAS 848321-15-3) is a chemical compound with molecular formula C15H8Cl3N3O3 and molecular weight 382.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate
Also Known As: AB00738874-01, [(3-chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate, [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate
| Molecular Formula | C15H8Cl3N3O3 |
|---|---|
| Molecular Weight | 382.96 g/mol |
| LogP | 3.70898 |
| Topological Polar Surface Area | 92.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.96313 |
| Heavy Atoms | 24 |
| Complexity | 849.58844 |
Chemical Identifiers
| CAS Number | 848321-15-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)COC(=O)C2=C(C=CC(=N2)Cl)Cl)Cl)C#N |
Product Overview
[(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate (CAS 848321-15-3), with molecular formula C15H8Cl3N3O3 and molecular weight 382.96 g/mol. IUPAC: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate.
Chemical Property Profile of [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
Property Insights of [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate
The XLogP value of 3.70898 indicates that [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-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 [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate. Following Lipinski's Rule of Five, [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-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 [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The CAS number of [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is 848321-15-3.
What is the molecular formula of [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The molecular formula of [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is C15H8Cl3N3O3.
What is the molecular weight of [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
The molecular weight of [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate is 382.96 g/mol.
Where can I buy [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
You can request a quote for [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(3-Chloro-4-cyanophenyl)carbamoyl]methyl 3,6-dichloropyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.