1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-
TL;DR: 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- (CAS 96734-49-5) is a chemical compound with molecular formula C17H13N3O6S and molecular weight 387.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylic acid
Also Known As: 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-, 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylic acid, 5-Phenyl-1-(4-sulfamoylphenyl)-1H-pyrazole-3,4-dicarboxylic acid
| Molecular Formula | C17H13N3O6S |
|---|---|
| Molecular Weight | 387.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.05252 |
| Heavy Atoms | 27 |
| Complexity | 665.0 |
Chemical Identifiers
| CAS Number | 96734-49-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(=O)O)C(=O)O |
| InChIKey | BUHVBEDJCLCTLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- (CAS 96734-49-5), with molecular formula C17H13N3O6S and molecular weight 387.05 g/mol. IUPAC: 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylic acid.
Chemical Property Profile of 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-
Property Insights of 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-. The TPSA of 161.0 Ų indicates high polarity, suggesting 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- has 3 hydrogen bond donor(s) and 8 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 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-?
The CAS number of 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- is 96734-49-5.
What is the molecular formula of 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-?
The molecular formula of 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- is C17H13N3O6S.
What is the molecular weight of 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-?
The molecular weight of 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- is 387.05 g/mol.
Where can I buy 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-?
You can request a quote for 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1h-pyrazole-3,4-dicarboxylic Acid, 1-(4-(aminosulfonyl)phenyl)-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.