Alanine, N-(2-amino-3,4-cresotoyl)-, DL-
TL;DR: Alanine, N-(2-amino-3,4-cresotoyl)-, DL- (CAS 18877-35-5) is a chemical compound with molecular formula C11H14N2O4 and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]propanoic acid
Also Known As: Alanine, N-(2-amino-3,4-cresotoyl)-, dl-, 3-Hydroxy-4-methyl-anthraniloyl-DL-alanin, N-(2-Amino-3-hydroxy-4-methylbenzoyl)alanine, N-(2-Amino-3-hydroxy-4-methylbenzoyl)alanine #, 2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]propanoic acid
| Molecular Formula | C11H14N2O4 |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.09535 |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 18877-35-5 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C(=O)NC(C)C(=O)O)N)O |
| InChIKey | NRABWKFPYIDLJZ-UHFFFAOYSA-N |
Product Overview
Alanine, N-(2-amino-3,4-cresotoyl)-, DL- (CAS 18877-35-5), with molecular formula C11H14N2O4 and molecular weight 238.10 g/mol. IUPAC: 2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]propanoic acid.
Chemical Property Profile of Alanine, N-(2-amino-3,4-cresotoyl)-, DL-
Property Insights of Alanine, N-(2-amino-3,4-cresotoyl)-, DL-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine, N-(2-amino-3,4-cresotoyl)-, DL-. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-(2-amino-3,4-cresotoyl)-, DL-. Following Lipinski's Rule of Five, Alanine, N-(2-amino-3,4-cresotoyl)-, DL- has 4 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 Alanine, N-(2-amino-3,4-cresotoyl)-, DL-?
The CAS number of Alanine, N-(2-amino-3,4-cresotoyl)-, DL- is 18877-35-5.
What is the molecular formula of Alanine, N-(2-amino-3,4-cresotoyl)-, DL-?
The molecular formula of Alanine, N-(2-amino-3,4-cresotoyl)-, DL- is C11H14N2O4.
What is the molecular weight of Alanine, N-(2-amino-3,4-cresotoyl)-, DL-?
The molecular weight of Alanine, N-(2-amino-3,4-cresotoyl)-, DL- is 238.10 g/mol.
Where can I buy Alanine, N-(2-amino-3,4-cresotoyl)-, DL-?
You can request a quote for Alanine, N-(2-amino-3,4-cresotoyl)-, DL- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, N-(2-amino-3,4-cresotoyl)-, DL-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-(2-amino-3,4-cresotoyl)-, DL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.