Alanine, N-(4-chlorophenyl)-2-methyl-
TL;DR: Alanine, N-(4-chlorophenyl)-2-methyl- (CAS 17413-86-4) is a chemical compound with molecular formula C10H12ClNO2 and molecular weight 213.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloroanilino)-2-methylpropanoic acid
Also Known As: Alanine, N-(4-chlorophenyl)-2-methyl-, 2-(4-chloroanilino)-2-methylpropanoic acid, N-(4-Chlorophenyl)-2-methylalanine, 2-((4-Chlorophenyl)amino)-2-methylpropanoic acid, 2-(4-Chloro-phenylamino)-2-methyl-propionic acid
| Molecular Formula | C10H12ClNO2 |
|---|---|
| Molecular Weight | 213.06 g/mol |
| LogP | 2.6151 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.05565 |
| Heavy Atoms | 14 |
| Complexity | 332.48016 |
Chemical Identifiers
| CAS Number | 17413-86-4 |
|---|---|
| SMILES | CC(C)(C(=O)O)NC1=CC=C(C=C1)Cl |
Product Overview
Alanine, N-(4-chlorophenyl)-2-methyl- (CAS 17413-86-4), with molecular formula C10H12ClNO2 and molecular weight 213.06 g/mol. IUPAC: 2-(4-chloroanilino)-2-methylpropanoic acid.
Chemical Property Profile of Alanine, N-(4-chlorophenyl)-2-methyl-
Property Insights of Alanine, N-(4-chlorophenyl)-2-methyl-
The XLogP value of 2.6151 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine, N-(4-chlorophenyl)-2-methyl-. With a topological polar surface area (TPSA) of 49.33 Ų, Alanine, N-(4-chlorophenyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alanine, N-(4-chlorophenyl)-2-methyl- has 2 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 Alanine, N-(4-chlorophenyl)-2-methyl-?
The CAS number of Alanine, N-(4-chlorophenyl)-2-methyl- is 17413-86-4.
What is the molecular formula of Alanine, N-(4-chlorophenyl)-2-methyl-?
The molecular formula of Alanine, N-(4-chlorophenyl)-2-methyl- is C10H12ClNO2.
What is the molecular weight of Alanine, N-(4-chlorophenyl)-2-methyl-?
The molecular weight of Alanine, N-(4-chlorophenyl)-2-methyl- is 213.06 g/mol.
Where can I buy Alanine, N-(4-chlorophenyl)-2-methyl-?
You can request a quote for Alanine, N-(4-chlorophenyl)-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, N-(4-chlorophenyl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-(4-chlorophenyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.