N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide
TL;DR: N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide (CAS 957490-13-0) is a chemical compound with molecular formula C8H6BrN5O3S and molecular weight 330.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide
Also Known As: N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide, N-(5-bromo-1,3-thiazol-2-yl)-4-nitro-1-methyl-1H-pyrazole-3-carboxamide, N~3~-(5-BROMO-1,3-THIAZOL-2-YL)-1-METHYL-4-NITRO-1H-PYRAZOLE-3-CARBOXAMIDE
| Molecular Formula | C8H6BrN5O3S |
|---|---|
| Molecular Weight | 330.94 g/mol |
| LogP | 1.7996 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.93747 |
| Heavy Atoms | 18 |
| Complexity | 622.03107 |
Chemical Identifiers
| CAS Number | 957490-13-0 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)NC2=NC=C(S2)Br)[N+](=O)[O-] |
Product Overview
N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide (CAS 957490-13-0), with molecular formula C8H6BrN5O3S and molecular weight 330.94 g/mol. IUPAC: N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide.
Chemical Property Profile of N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide
Property Insights of N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide
The XLogP value of 1.7996 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide. The TPSA of 102.95 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-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 N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide?
The CAS number of N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide is 957490-13-0.
What is the molecular formula of N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide?
The molecular formula of N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide is C8H6BrN5O3S.
What is the molecular weight of N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide?
The molecular weight of N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide is 330.94 g/mol.
Where can I buy N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide?
You can request a quote for N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-4-nitropyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.