2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide
TL;DR: 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide (CAS 515847-85-5) is a chemical compound with molecular formula C10H10N4O3S and molecular weight 266.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-5-carboxamide
Also Known As: 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide, 4-nitro-1-methyl-N-(2-thienylmethyl)-1H-pyrazole-5-carboxamide, 1-methyl-4-nitro-N-(thiophen-2-ylmethyl)-1H-pyrazole-5-carboxamide, 1-METHYL-4-NITRO-N-(2-THIENYLMETHYL)-1H-PYRAZOLE-5-CARBOXAMIDE
| Molecular Formula | C10H10N4O3S |
|---|---|
| Molecular Weight | 266.05 g/mol |
| LogP | 1.3198 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.04736 |
| Heavy Atoms | 18 |
| Complexity | 575.96704 |
Chemical Identifiers
| CAS Number | 515847-85-5 |
|---|---|
| SMILES | CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCC2=CC=CS2 |
Product Overview
2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide (CAS 515847-85-5), with molecular formula C10H10N4O3S and molecular weight 266.05 g/mol. IUPAC: 1-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-5-carboxamide.
Chemical Property Profile of 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide
Property Insights of 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide
The XLogP value of 1.3198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide has 1 hydrogen bond donor(s) and 5 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 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide?
The CAS number of 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide is 515847-85-5.
What is the molecular formula of 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide?
The molecular formula of 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide is C10H10N4O3S.
What is the molecular weight of 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide?
The molecular weight of 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide is 266.05 g/mol.
Where can I buy 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide?
You can request a quote for 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-4-nitro-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.