(2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid
TL;DR: (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid (CAS 380471-75-0) is a chemical compound with molecular formula C12H13FN2O4 and molecular weight 268.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-5-amino-2-[(4-fluorobenzoyl)amino]-5-oxopentanoic acid
Also Known As: (4-Fluorobenzoyl)-l-glutamine, (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid, (2S)-5-amino-2-[(4-fluorobenzoyl)amino]-5-oxopentanoic acid, 4-carbamoyl-2-[(4-fluorobenzoyl)amino]butanoic Acid, (2S)-4-carbamoyl-2-(4-fluorophenyl)formamidobutanoic acid
| Molecular Formula | C12H13FN2O4 |
|---|---|
| Molecular Weight | 268.09 g/mol |
| LogP | 0.2742 |
| Topological Polar Surface Area | 109.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 268.08594 |
| Heavy Atoms | 19 |
| Complexity | 487.0077 |
Chemical Identifiers
| CAS Number | 380471-75-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)N)C(=O)O)F |
Product Overview
(2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid (CAS 380471-75-0), with molecular formula C12H13FN2O4 and molecular weight 268.09 g/mol. IUPAC: (2S)-5-amino-2-[(4-fluorobenzoyl)amino]-5-oxopentanoic acid.
Chemical Property Profile of (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid
Property Insights of (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid
The XLogP value of 0.2742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid. The TPSA of 109.49 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid. Following Lipinski's Rule of Five, (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid has 3 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 (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid?
The CAS number of (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid is 380471-75-0.
What is the molecular formula of (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid?
The molecular formula of (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid is C12H13FN2O4.
What is the molecular weight of (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid?
The molecular weight of (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid is 268.09 g/mol.
Where can I buy (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid?
You can request a quote for (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-4-carbamoyl-2-[(4-fluorophenyl)formamido]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.