(S)-2-(3-pentylureido)-3-phenylpropanoic acid
TL;DR: (S)-2-(3-pentylureido)-3-phenylpropanoic acid (CAS 1173665-66-1) is a chemical compound with molecular formula C15H22N2O3 and molecular weight 278.16306 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(pentylcarbamoylamino)-3-phenylpropanoic acid
Also Known As: (S)-2-(3-pentylureido)-3-phenylpropanoic acid, 2-(pentylcarbamoylamino)-3-phenyl-propanoic Acid, (2S)-2-(pentylcarbamoylamino)-3-phenylpropanoic acid
Technical Specifications
| Molecular Formula | C15H22N2O3 |
| Molecular Weight | 278.16306 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.16306 Da |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
| SMILES | CCCCCNC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O |
| InChIKey | NEWSLBHINDSRQZ-ZDUSSCGKSA-N |
Chemical Property Profile of (S)-2-(3-pentylureido)-3-phenylpropanoic acid
Property Insights of (S)-2-(3-pentylureido)-3-phenylpropanoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(3-pentylureido)-3-phenylpropanoic acid. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(3-pentylureido)-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (S)-2-(3-pentylureido)-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-pentylureido)-3-phenylpropanoic acid?
The CAS number of (S)-2-(3-pentylureido)-3-phenylpropanoic acid is 1173665-66-1.
What is the molecular formula of (S)-2-(3-pentylureido)-3-phenylpropanoic acid?
The molecular formula of (S)-2-(3-pentylureido)-3-phenylpropanoic acid is C15H22N2O3.
What is the molecular weight of (S)-2-(3-pentylureido)-3-phenylpropanoic acid?
The molecular weight of (S)-2-(3-pentylureido)-3-phenylpropanoic acid is 278.16306 g/mol.
Where can I buy (S)-2-(3-pentylureido)-3-phenylpropanoic acid?
You can request a quote for (S)-2-(3-pentylureido)-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-pentylureido)-3-phenylpropanoic acid?
Yes, CoreyChem provides custom synthesis services for (S)-2-(3-pentylureido)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.