(S)-2-(3-phenethylureido)-3-phenylpropanoic acid
TL;DR: (S)-2-(3-phenethylureido)-3-phenylpropanoic acid (CAS 1173674-29-7) is a chemical compound with molecular formula C18H20N2O3 and molecular weight 312.1474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-2-(2-phenylethylcarbamoylamino)propanoic acid
Also Known As: N-[(2-phenylethyl)carbamoyl]phenylalanine, (S)-2-(3-phenethylureido)-3-phenylpropanoic acid, 2-(phenethylcarbamoylamino)-3-phenylpropanoic acid, 2-(phenethylcarbamoylamino)-3-phenyl-propanoic Acid, 3-phenyl-2-(2-phenylethylcarbamoylamino)propanoic acid
Technical Specifications
| Molecular Formula | C18H20N2O3 |
| Molecular Weight | 312.1474 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 312.1474 Da |
| Heavy Atoms | 23 |
| Complexity | 374.0 |
| SMILES | C1=CC=C(C=C1)CCNC(=O)NC(CC2=CC=CC=C2)C(=O)O |
| InChIKey | IOPNVZDAZXKDEU-UHFFFAOYSA-N |
Chemical Property Profile of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid
Property Insights of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(3-phenethylureido)-3-phenylpropanoic acid. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(3-phenethylureido)-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (S)-2-(3-phenethylureido)-3-phenylpropanoic 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
What is the CAS number of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid?
The CAS number of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid is 1173674-29-7.
What is the molecular formula of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid?
The molecular formula of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid is C18H20N2O3.
What is the molecular weight of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid?
The molecular weight of (S)-2-(3-phenethylureido)-3-phenylpropanoic acid is 312.1474 g/mol.
Where can I buy (S)-2-(3-phenethylureido)-3-phenylpropanoic acid?
You can request a quote for (S)-2-(3-phenethylureido)-3-phenylpropanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-2-(3-phenethylureido)-3-phenylpropanoic acid?
Yes, CoreyChem provides custom synthesis services for (S)-2-(3-phenethylureido)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.