N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide
TL;DR: N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide (CAS 957513-90-5) is a chemical compound with molecular formula C13H13ClN4O2 and molecular weight 292.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-acetamidophenyl)-4-chloro-1-methylpyrazole-5-carboxamide
Also Known As: N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide, 4-CHLORO-N-(3-ACETAMIDOPHENYL)-1-METHYL-1H-PYRAZOLE-5-CARBOXAMIDE, N-[3-(acetylamino)phenyl]-4-chloro-1-methyl-1H-pyrazole-5-carboxamide, N-{3-[(4-chloro-1-methylpyrazol-5-yl)carbonylamino]phenyl}acetamide
| Molecular Formula | C13H13ClN4O2 |
|---|---|
| Molecular Weight | 292.07 g/mol |
| LogP | 2.2842 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.0727 |
| Heavy Atoms | 20 |
| Complexity | 646.6408 |
Chemical Identifiers
| CAS Number | 957513-90-5 |
|---|---|
| SMILES | CC(=O)NC1=CC(=CC=C1)NC(=O)C2=C(C=NN2C)Cl |
Product Overview
N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide (CAS 957513-90-5), with molecular formula C13H13ClN4O2 and molecular weight 292.07 g/mol. IUPAC: N-(3-acetamidophenyl)-4-chloro-1-methylpyrazole-5-carboxamide.
Chemical Property Profile of N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide
Property Insights of N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide
The XLogP value of 2.2842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide has 2 hydrogen bond donor(s) and 3 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-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide?
The CAS number of N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide is 957513-90-5.
What is the molecular formula of N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide?
The molecular formula of N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide is C13H13ClN4O2.
What is the molecular weight of N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide?
The molecular weight of N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide is 292.07 g/mol.
Where can I buy N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide?
You can request a quote for N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-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-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-acetamidophenyl)-4-chloro-2-methylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.