Alanine, N-(4-fluorobenzoyl)-
TL;DR: Alanine, N-(4-fluorobenzoyl)- (CAS 451-28-5) is a chemical compound with molecular formula C10H10FNO3 and molecular weight 211.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(4-fluorobenzoyl)amino]propanoic acid
Also Known As: Alanine, N-(4-fluorobenzoyl)-, N-(4-Fluorobenzoyl)-L-alanine, (2S)-2-[(4-fluorobenzoyl)amino]propanoic acid, BAS 00570602, (s)-2-(4-fluoro-benzoylamino)-propionic acid
| Molecular Formula | C10H10FNO3 |
|---|---|
| Molecular Weight | 211.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.06447 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 451-28-5 |
|---|---|
| SMILES | C[C@@H](C(=O)O)NC(=O)C1=CC=C(C=C1)F |
| InChIKey | RICKYTLEGMVQTI-LURJTMIESA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alanine, N-(4-fluorobenzoyl)- (CAS 451-28-5), with molecular formula C10H10FNO3 and molecular weight 211.06 g/mol. IUPAC: (2S)-2-[(4-fluorobenzoyl)amino]propanoic acid.
Chemical Property Profile of Alanine, N-(4-fluorobenzoyl)-
Property Insights of Alanine, N-(4-fluorobenzoyl)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine, N-(4-fluorobenzoyl)-. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-(4-fluorobenzoyl)-. Following Lipinski's Rule of Five, Alanine, N-(4-fluorobenzoyl)- has 2 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 Alanine, N-(4-fluorobenzoyl)-?
The CAS number of Alanine, N-(4-fluorobenzoyl)- is 451-28-5.
What is the molecular formula of Alanine, N-(4-fluorobenzoyl)-?
The molecular formula of Alanine, N-(4-fluorobenzoyl)- is C10H10FNO3.
What is the molecular weight of Alanine, N-(4-fluorobenzoyl)-?
The molecular weight of Alanine, N-(4-fluorobenzoyl)- is 211.06 g/mol.
Where can I buy Alanine, N-(4-fluorobenzoyl)-?
You can request a quote for Alanine, N-(4-fluorobenzoyl)- 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-fluorobenzoyl)-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-(4-fluorobenzoyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.