(S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid
TL;DR: (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid (CAS 958951-35-4) is a chemical compound with molecular formula C11H13FN2O3 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(4-fluorophenyl)methylcarbamoylamino]propanoic acid
Also Known As: (S)-2-(3-(4-fluorobenzyl)ureido)propanoic acid, (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid, (2S)-2-[(4-fluorophenyl)methylcarbamoylamino]propanoic acid
| Molecular Formula | C11H13FN2O3 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 1.098 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.09102 |
| Heavy Atoms | 17 |
| Complexity | 405.6825 |
Chemical Identifiers
| CAS Number | 958951-35-4 |
|---|---|
| SMILES | C[C@@H](C(=O)O)NC(=O)NCC1=CC=C(C=C1)F |
Product Overview
(S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid (CAS 958951-35-4), with molecular formula C11H13FN2O3 and molecular weight 240.09 g/mol. IUPAC: (2S)-2-[(4-fluorophenyl)methylcarbamoylamino]propanoic acid.
Chemical Property Profile of (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid
Property Insights of (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid
The XLogP value of 1.098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid. Following Lipinski's Rule of Five, (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid 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 (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid?
The CAS number of (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid is 958951-35-4.
What is the molecular formula of (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid?
The molecular formula of (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid is C11H13FN2O3.
What is the molecular weight of (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid?
The molecular weight of (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid is 240.09 g/mol.
Where can I buy (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid?
You can request a quote for (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-[3-(4-Fluoro-benzyl)-ureido]-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.