![methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate structure](/static/products/956/956397-16-3.png)
methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate
TL;DR: methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate (CAS 956397-16-3) is a chemical compound with molecular formula C12H15ClN2O3 and molecular weight 270.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[(2-chlorophenyl)methylcarbamoylamino]propanoate
Also Known As: methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate, (S)-methyl 2-(3-(2-chlorobenzyl)ureido)propanoate, Methyl N-{[(2-chlorophenyl)methyl]carbamoyl}-L-alaninate, methyl (2S)-2-[(2-chlorophenyl)methylcarbamoylamino]propanoate, N-[[[(2-Chlorophenyl)methyl]amino]carbonyl]-L-alanine methyl ester
| Molecular Formula | C12H15ClN2O3 |
|---|---|
| Molecular Weight | 270.08 g/mol |
| LogP | 1.7007 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.07712 |
| Heavy Atoms | 18 |
| Complexity | 437.08563 |
Chemical Identifiers
| CAS Number | 956397-16-3 |
|---|---|
| SMILES | C[C@@H](C(=O)OC)NC(=O)NCC1=CC=CC=C1Cl |
Product Overview
methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate (CAS 956397-16-3), with molecular formula C12H15ClN2O3 and molecular weight 270.08 g/mol. IUPAC: methyl (2S)-2-[(2-chlorophenyl)methylcarbamoylamino]propanoate.
Chemical Property Profile of methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate
Property Insights of methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate
The XLogP value of 1.7007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate. Following Lipinski's Rule of Five, methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate has 2 hydrogen bond donor(s) and 3 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 methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate?
The CAS number of methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate is 956397-16-3.
What is the molecular formula of methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate?
The molecular formula of methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate is C12H15ClN2O3.
What is the molecular weight of methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate?
The molecular weight of methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate is 270.08 g/mol.
Where can I buy methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate?
You can request a quote for methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[(2-chlorobenzyl)carbamoyl]-L-alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.