5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole
TL;DR: 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole (CAS 19933-29-0) is a chemical compound with molecular formula C7H3N5O6S and molecular weight 284.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole
Also Known As: 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole, 3-(3,5-Dinitro-2-thienyl)-4-nitro-1H-pyrazole, 5-{3,5-bisnitro-2-thienyl}-4-nitro-1H-pyrazole, AI-942/13331219, 3-(3,5-Dinitrothiophen-2-yl)-4-nitro-1H-pyrazole
| Molecular Formula | C7H3N5O6S |
|---|---|
| Molecular Weight | 284.98 g/mol |
| LogP | 1.8628 |
| Topological Polar Surface Area | 158.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.9804 |
| Heavy Atoms | 19 |
| Complexity | 689.9644 |
Chemical Identifiers
| CAS Number | 19933-29-0 |
|---|---|
| SMILES | C1=C(SC(=C1[N+](=O)[O-])C2=C(C=NN2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole (CAS 19933-29-0), with molecular formula C7H3N5O6S and molecular weight 284.98 g/mol. IUPAC: 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole.
Chemical Property Profile of 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole
Property Insights of 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole
The XLogP value of 1.8628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole. The TPSA of 158.1 Ų indicates high polarity, suggesting 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole has 1 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 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole?
The CAS number of 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole is 19933-29-0.
What is the molecular formula of 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole?
The molecular formula of 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole is C7H3N5O6S.
What is the molecular weight of 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole?
The molecular weight of 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole is 284.98 g/mol.
Where can I buy 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole?
You can request a quote for 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,5-dinitrothiophen-2-yl)-4-nitro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.