(S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid
TL;DR: (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid (CAS 87661-71-0) is a chemical compound with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenylpropanoic acid
Also Known As: (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid, J2.147.600E, N-(4-Acetamidobenzene-1-sulfonyl)-L-phenylalanine, N-[4-(Acetylamino)phenylsulfonyl]-L-phenylalanine, Nalpha-(4-acetamidobenzenesulfonyl)-L-phenylalanine
| Molecular Formula | C17H18N2O5S |
|---|---|
| Molecular Weight | 362.09 g/mol |
| LogP | 1.6192 |
| Topological Polar Surface Area | 112.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 362.09363 |
| Heavy Atoms | 25 |
| Complexity | 848.36676 |
Chemical Identifiers
| CAS Number | 87661-71-0 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O |
Product Overview
(S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid (CAS 87661-71-0), with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol. IUPAC: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenylpropanoic acid.
Chemical Property Profile of (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid
Property Insights of (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid
The XLogP value of 1.6192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid. The TPSA of 112.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid has 3 hydrogen bond donor(s) and 4 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-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid?
The CAS number of (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid is 87661-71-0.
What is the molecular formula of (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid?
The molecular formula of (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid is C17H18N2O5S.
What is the molecular weight of (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid?
The molecular weight of (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid is 362.09 g/mol.
Where can I buy (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid?
You can request a quote for (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic 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-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(4-acetamidophenylsulfonamido)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.