Alanine, N-benzenesulfonyl-3-phenyl-, DL-
TL;DR: Alanine, N-benzenesulfonyl-3-phenyl-, DL- (CAS 40279-93-4) is a chemical compound with molecular formula C15H15NO4S and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonamido)-3-phenylpropanoic acid
Also Known As: N-(phenylsulfonyl)phenylalanine, D-N-Benzenesulfonyl-3-phenylalanine, DL-N-Benzenesulfonyl-3-phenylalanine, N-(Benzenesulfonyl)phenylalanine, Propionic acid, 2-benzenesulfonamido-3-phenyl-, D-
| Molecular Formula | C15H15NO4S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 305.07217 |
| Heavy Atoms | 21 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 40279-93-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)NS(=O)(=O)C2=CC=CC=C2 |
| InChIKey | PICQEJDBZKDWOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alanine, N-benzenesulfonyl-3-phenyl-, DL- (CAS 40279-93-4), with molecular formula C15H15NO4S and molecular weight 305.07 g/mol. IUPAC: 2-(benzenesulfonamido)-3-phenylpropanoic acid.
Chemical Property Profile of Alanine, N-benzenesulfonyl-3-phenyl-, DL-
Property Insights of Alanine, N-benzenesulfonyl-3-phenyl-, DL-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine, N-benzenesulfonyl-3-phenyl-, DL-. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-benzenesulfonyl-3-phenyl-, DL-. Following Lipinski's Rule of Five, Alanine, N-benzenesulfonyl-3-phenyl-, DL- has 2 hydrogen bond donor(s) and 5 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 Alanine, N-benzenesulfonyl-3-phenyl-, DL-?
The CAS number of Alanine, N-benzenesulfonyl-3-phenyl-, DL- is 40279-93-4.
What is the molecular formula of Alanine, N-benzenesulfonyl-3-phenyl-, DL-?
The molecular formula of Alanine, N-benzenesulfonyl-3-phenyl-, DL- is C15H15NO4S.
What is the molecular weight of Alanine, N-benzenesulfonyl-3-phenyl-, DL-?
The molecular weight of Alanine, N-benzenesulfonyl-3-phenyl-, DL- is 305.07 g/mol.
Where can I buy Alanine, N-benzenesulfonyl-3-phenyl-, DL-?
You can request a quote for Alanine, N-benzenesulfonyl-3-phenyl-, DL- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, N-benzenesulfonyl-3-phenyl-, DL-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-benzenesulfonyl-3-phenyl-, DL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.