5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate
TL;DR: 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate (CAS 442679-28-9) is a chemical compound with molecular formula C14H10FN3O4S2 and molecular weight 367.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-amino-1-(4-fluorophenyl)sulfonylpyrazol-3-yl] thiophene-2-carboxylate
Also Known As: PCMD-CC-MCM-2, [5-amino-1-(4-fluorophenyl)sulfonylpyrazol-3-yl] thiophene-2-carboxylate, 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate, 5-amino-1-[(4-fluorophenyl)sulfonyl]-1H-pyrazol-3-yl thiophene-2-carboxylate, [5-azanyl-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] thiophene-2-carboxylate
| Molecular Formula | C14H10FN3O4S2 |
|---|---|
| Molecular Weight | 367.01 g/mol |
| LogP | 2.1221 |
| Topological Polar Surface Area | 104.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.00967 |
| Heavy Atoms | 24 |
| Complexity | 979.7134 |
Chemical Identifiers
| CAS Number | 442679-28-9 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC=C(C=C3)F |
Product Overview
5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate (CAS 442679-28-9), with molecular formula C14H10FN3O4S2 and molecular weight 367.01 g/mol. IUPAC: [5-amino-1-(4-fluorophenyl)sulfonylpyrazol-3-yl] thiophene-2-carboxylate.
Chemical Property Profile of 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate
Property Insights of 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate
The XLogP value of 2.1221 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate. The TPSA of 104.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate. Following Lipinski's Rule of Five, 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate has 1 hydrogen bond donor(s) and 7 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 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate?
The CAS number of 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate is 442679-28-9.
What is the molecular formula of 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate?
The molecular formula of 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate is C14H10FN3O4S2.
What is the molecular weight of 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate?
The molecular weight of 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate is 367.01 g/mol.
Where can I buy 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate?
You can request a quote for 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.