Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-
TL;DR: Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- (CAS 50714-08-4) is a chemical compound with molecular formula C15H16N2O4S and molecular weight 320.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-(2-phenylethyl)-5-sulfamoylbenzoic acid
Also Known As: Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-, 3-Amino-5-(aminosulfonyl)-4-(2-phenylethyl)benzoic acid, 3-amino-4-phenethyl-5-sulfamoylbenzoic acid, 3-amino-4-(2-phenylethyl)-5-sulfamoylbenzoic acid, BRN 2769009
| Molecular Formula | C15H16N2O4S |
|---|---|
| Molecular Weight | 320.08 g/mol |
| LogP | 1.3996 |
| Topological Polar Surface Area | 123.48 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.08307 |
| Heavy Atoms | 22 |
| Complexity | 801.7922 |
Chemical Identifiers
| CAS Number | 50714-08-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N |
Product Overview
Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- (CAS 50714-08-4), with molecular formula C15H16N2O4S and molecular weight 320.08 g/mol. IUPAC: 3-amino-4-(2-phenylethyl)-5-sulfamoylbenzoic acid.
Chemical Property Profile of Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-
Property Insights of Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-
The XLogP value of 1.3996 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-. The TPSA of 123.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-. Following Lipinski's Rule of Five, Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- 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 Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-?
The CAS number of Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- is 50714-08-4.
What is the molecular formula of Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-?
The molecular formula of Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- is C15H16N2O4S.
What is the molecular weight of Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-?
The molecular weight of Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- is 320.08 g/mol.
Where can I buy Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-?
You can request a quote for Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3-amino-5-(aminosulfonyl)-4-(2-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.