![[(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate structure](/static/products/4795/479534-34-4.webp)
[(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
TL;DR: [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate (CAS 479534-34-4) is a chemical compound with molecular formula C16H15ClN2O3 and molecular weight 318.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(2-phenylethylamino)ethyl] 2-chloropyridine-3-carboxylate
Also Known As: [2-oxo-2-(phenethylamino)ethyl] 2-chloropyridine-3-carboxylate|[2-oxo-2-(2-phenylethylamino)ethyl] 2-chloropyridine-3-carboxylate|[(2-PHENYLETHYL)CARBAMOYL]METHYL 2-CHLOROPYRIDINE-3-CARBOXYLATE|MLS002171766|SMR001252056|EN300-26587564
| Molecular Formula | C16H15ClN2O3 |
|---|---|
| Molecular Weight | 318.08 g/mol |
| LogP | 2.2507 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 318.07712 |
| Heavy Atoms | 22 |
| Complexity | 646.849 |
Chemical Identifiers
| CAS Number | 479534-34-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=O)COC(=O)C2=C(N=CC=C2)Cl |
Product Overview
[(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate (CAS 479534-34-4), with molecular formula C16H15ClN2O3 and molecular weight 318.08 g/mol. IUPAC: [2-oxo-2-(2-phenylethylamino)ethyl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
Property Insights of [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
The XLogP value of 2.2507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate has 1 hydrogen bond donor(s) and 4 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-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
The CAS number of [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate is 479534-34-4.
What is the molecular formula of [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
The molecular formula of [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate is C16H15ClN2O3.
What is the molecular weight of [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
The molecular weight of [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate is 318.08 g/mol.
Where can I buy [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
You can request a quote for [(2-Phenylethyl)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 [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(2-Phenylethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.