({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate
TL;DR: ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate (CAS 876934-52-0) is a chemical compound with molecular formula C17H15Cl2N3O4 and molecular weight 395.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] 6-chloropyridine-3-carboxylate
Also Known As: ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate, [2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] 6-chloropyridine-3-carboxylate, [(2-chlorophenyl)carbamoylmethyl-methyl-carbamoyl]methyl 6-chloropyridine-3-carboxylate
| Molecular Formula | C17H15Cl2N3O4 |
|---|---|
| Molecular Weight | 395.04 g/mol |
| LogP | 2.6423 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.04398 |
| Heavy Atoms | 26 |
| Complexity | 811.9102 |
Chemical Identifiers
| CAS Number | 876934-52-0 |
|---|---|
| SMILES | CN(CC(=O)NC1=CC=CC=C1Cl)C(=O)COC(=O)C2=CN=C(C=C2)Cl |
Product Overview
({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate (CAS 876934-52-0), with molecular formula C17H15Cl2N3O4 and molecular weight 395.04 g/mol. IUPAC: [2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] 6-chloropyridine-3-carboxylate.
Chemical Property Profile of ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate
Property Insights of ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate
The XLogP value of 2.6423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-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 ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate?
The CAS number of ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate is 876934-52-0.
What is the molecular formula of ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate?
The molecular formula of ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate is C17H15Cl2N3O4.
What is the molecular weight of ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate?
The molecular weight of ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate is 395.04 g/mol.
Where can I buy ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate?
You can request a quote for ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-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 ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ({[(2-chlorophenyl)carbamoyl]methyl}(methyl)carbamoyl)methyl 6-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.