![(S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid structure](/static/products/288/288087-92-3.png)
(S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid
TL;DR: (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid (CAS 288087-92-3) is a chemical compound with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(4-methylphenyl)methylcarbamoylamino]-3-phenylpropanoic acid
Also Known As: N-[(4-methylbenzyl)carbamoyl]-L-phenylalanine, (S)-2-(3-(4-methylbenzyl)ureido)-3-phenylpropanoic acid, (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid, (2S)-2-[(4-methylphenyl)methylcarbamoylamino]-3-phenylpropanoic acid, REGID_for_CID_941561
| Molecular Formula | C18H20N2O3 |
|---|---|
| Molecular Weight | 312.15 g/mol |
| LogP | 2.49012 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.1474 |
| Heavy Atoms | 23 |
| Complexity | 653.72675 |
Chemical Identifiers
| CAS Number | 288087-92-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O |
Product Overview
(S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid (CAS 288087-92-3), with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol. IUPAC: (2S)-2-[(4-methylphenyl)methylcarbamoylamino]-3-phenylpropanoic acid.
Chemical Property Profile of (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid
Property Insights of (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid
The XLogP value of 2.49012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid. Following Lipinski's Rule of Five, (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-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-Methyl-benzyl)-ureido]-3-phenyl-propionic acid?
The CAS number of (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid is 288087-92-3.
What is the molecular formula of (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid?
The molecular formula of (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid is C18H20N2O3.
What is the molecular weight of (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid?
The molecular weight of (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid is 312.15 g/mol.
Where can I buy (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid?
You can request a quote for (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-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-Methyl-benzyl)-ureido]-3-phenyl-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-[3-(4-Methyl-benzyl)-ureido]-3-phenyl-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.