1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide
TL;DR: 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide (CAS 512827-63-3) is a chemical compound with molecular formula C8H7N5O3S and molecular weight 253.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-nitro-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide
Also Known As: 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide, 2-methyl-4-nitro-N-(1,3-thiazol-2-yl)pyrazole-3-carboxamide, 1H-Pyrazole-5-carboxamide,1-methyl-4-nitro-N-2-thiazolyl-(9CI), 4-nitro-1-methyl-N-(1,3-thiazol-2-yl)-1H-pyrazole-5-carboxamide, 1H-Pyrazole-5-carboxamide, 1-methyl-4-nitro-N-2-thiazolyl- (9CI)
| Molecular Formula | C8H7N5O3S |
|---|---|
| Molecular Weight | 253.03 g/mol |
| LogP | 1.0371 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.02696 |
| Heavy Atoms | 17 |
| Complexity | 561.7326 |
Chemical Identifiers
| CAS Number | 512827-63-3 |
|---|---|
| SMILES | CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NC=CS2 |
Product Overview
1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide (CAS 512827-63-3), with molecular formula C8H7N5O3S and molecular weight 253.03 g/mol. IUPAC: 1-methyl-4-nitro-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide.
Chemical Property Profile of 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide
Property Insights of 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide
The XLogP value of 1.0371 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide. The TPSA of 102.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide has 1 hydrogen bond donor(s) and 6 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 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide?
The CAS number of 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide is 512827-63-3.
What is the molecular formula of 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide?
The molecular formula of 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide is C8H7N5O3S.
What is the molecular weight of 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide?
The molecular weight of 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide is 253.03 g/mol.
Where can I buy 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide?
You can request a quote for 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-nitro-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.