![N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine structure](/static/products/117/1173676-91-9.png)
N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine
TL;DR: N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine (CAS 1173676-91-9) is a chemical compound with molecular formula C11H13ClN2O3 and molecular weight 256.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(3-chloro-4-methylphenyl)carbamoylamino]propanoic acid
Also Known As: N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine, (S)-2-(3-(3-chloro-4-methylphenyl)ureido)propanoic acid, 2-[(3-chloro-4-methyl-phenyl)carbamoylamino]propanoic Acid, (2S)-2-[(3-chloro-4-methylphenyl)carbamoylamino]propanoic acid
| Molecular Formula | C11H13ClN2O3 |
|---|---|
| Molecular Weight | 256.06 g/mol |
| LogP | 2.24302 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.06146 |
| Heavy Atoms | 17 |
| Complexity | 448.3427 |
Chemical Identifiers
| CAS Number | 1173676-91-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)N[C@@H](C)C(=O)O)Cl |
Product Overview
N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine (CAS 1173676-91-9), with molecular formula C11H13ClN2O3 and molecular weight 256.06 g/mol. IUPAC: (2S)-2-[(3-chloro-4-methylphenyl)carbamoylamino]propanoic acid.
Chemical Property Profile of N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine
Property Insights of N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine
The XLogP value of 2.24302 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine. Following Lipinski's Rule of Five, N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine has 3 hydrogen bond donor(s) and 2 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 N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine?
The CAS number of N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine is 1173676-91-9.
What is the molecular formula of N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine?
The molecular formula of N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine is C11H13ClN2O3.
What is the molecular weight of N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine?
The molecular weight of N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine is 256.06 g/mol.
Where can I buy N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine?
You can request a quote for N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-chloro-4-methylphenyl)carbamoyl]-L-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.