4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide
TL;DR: 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide (CAS 490014-22-7) is a chemical compound with molecular formula C13H13ClN4O3 and molecular weight 308.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1,3-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-5-carboxamide
Also Known As: 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide, 4-chloro-1,3-dimethyl-N-(2-methyl-5-nitrophenyl)-1H-pyrazole-5-carboxamide, 4-chloro-N-{5-nitro-2-methylphenyl}-1,3-dimethyl-1H-pyrazole-5-carboxamide
| Molecular Formula | C13H13ClN4O3 |
|---|---|
| Molecular Weight | 308.07 g/mol |
| LogP | 2.85084 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.06763 |
| Heavy Atoms | 21 |
| Complexity | 739.2579 |
Chemical Identifiers
| CAS Number | 490014-22-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(C(=NN2C)C)Cl |
Product Overview
4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide (CAS 490014-22-7), with molecular formula C13H13ClN4O3 and molecular weight 308.07 g/mol. IUPAC: 4-chloro-1,3-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-5-carboxamide.
Chemical Property Profile of 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide
Property Insights of 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide
The XLogP value of 2.85084 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide 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-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide?
The CAS number of 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide is 490014-22-7.
What is the molecular formula of 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide?
The molecular formula of 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide is C13H13ClN4O3.
What is the molecular weight of 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide?
The molecular weight of 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide is 308.07 g/mol.
Where can I buy 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide?
You can request a quote for 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)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 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-2,5-dimethyl-N-(2-methyl-5-nitrophenyl)pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.