Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-
TL;DR: Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL- (CAS 37642-61-8) is a chemical compound with molecular formula C15H14BrNO4S and molecular weight 382.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)sulfonylamino]-3-phenylpropanoic acid
Also Known As: TRIPHENYLTINFLUORIDE, 2-{[(4-bromophenyl)sulfonyl]amino}-3-phenylpropanoic acid, ((4-Bromophenyl)sulfonyl)phenylalanine, 1937AE, DL-N-(p-Bromobenzenesulfonyl)-3-phenylanine
| Molecular Formula | C15H14BrNO4S |
|---|---|
| Molecular Weight | 382.98 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.9827 |
| Heavy Atoms | 22 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 37642-61-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Br |
| InChIKey | YYNNRJWNBXEQTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL- (CAS 37642-61-8), with molecular formula C15H14BrNO4S and molecular weight 382.98 g/mol. IUPAC: 2-[(4-bromophenyl)sulfonylamino]-3-phenylpropanoic acid.
Chemical Property Profile of Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-
Property Insights of Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-
The XLogP value of 3.2 indicates that Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-. Following Lipinski's Rule of Five, Alanine, N-(p-bromobenzenesulfonyl)-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-(p-bromobenzenesulfonyl)-3-phenyl-, DL-?
The CAS number of Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL- is 37642-61-8.
What is the molecular formula of Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-?
The molecular formula of Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL- is C15H14BrNO4S.
What is the molecular weight of Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-?
The molecular weight of Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL- is 382.98 g/mol.
Where can I buy Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-?
You can request a quote for Alanine, N-(p-bromobenzenesulfonyl)-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-(p-bromobenzenesulfonyl)-3-phenyl-, DL-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.