4-(5-nitrothiophen-2-yl)-1H-pyrazole
TL;DR: 4-(5-nitrothiophen-2-yl)-1H-pyrazole (CAS 488782-31-6) is a chemical compound with molecular formula C7H5N3O2S and molecular weight 195.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-nitrothiophen-2-yl)-1H-pyrazole
Also Known As: 4-(5-nitrothiophen-2-yl)-1H-pyrazole, 4-(5-nitro-2-thienyl)-1H-pyrazole, AI-942/13331063
| Molecular Formula | C7H5N3O2S |
|---|---|
| Molecular Weight | 195.01 g/mol |
| LogP | 2.0464 |
| Topological Polar Surface Area | 71.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.01025 |
| Heavy Atoms | 13 |
| Complexity | 420.63934 |
Chemical Identifiers
| CAS Number | 488782-31-6 |
|---|---|
| SMILES | C1=C(SC(=C1)[N+](=O)[O-])C2=CNN=C2 |
Product Overview
4-(5-nitrothiophen-2-yl)-1H-pyrazole (CAS 488782-31-6), with molecular formula C7H5N3O2S and molecular weight 195.01 g/mol. IUPAC: 4-(5-nitrothiophen-2-yl)-1H-pyrazole.
Chemical Property Profile of 4-(5-nitrothiophen-2-yl)-1H-pyrazole
Property Insights of 4-(5-nitrothiophen-2-yl)-1H-pyrazole
The XLogP value of 2.0464 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(5-nitrothiophen-2-yl)-1H-pyrazole. The TPSA of 71.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(5-nitrothiophen-2-yl)-1H-pyrazole. Following Lipinski's Rule of Five, 4-(5-nitrothiophen-2-yl)-1H-pyrazole has 1 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 4-(5-nitrothiophen-2-yl)-1H-pyrazole?
The CAS number of 4-(5-nitrothiophen-2-yl)-1H-pyrazole is 488782-31-6.
What is the molecular formula of 4-(5-nitrothiophen-2-yl)-1H-pyrazole?
The molecular formula of 4-(5-nitrothiophen-2-yl)-1H-pyrazole is C7H5N3O2S.
What is the molecular weight of 4-(5-nitrothiophen-2-yl)-1H-pyrazole?
The molecular weight of 4-(5-nitrothiophen-2-yl)-1H-pyrazole is 195.01 g/mol.
Where can I buy 4-(5-nitrothiophen-2-yl)-1H-pyrazole?
You can request a quote for 4-(5-nitrothiophen-2-yl)-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(5-nitrothiophen-2-yl)-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(5-nitrothiophen-2-yl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.