N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
TL;DR: N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide (CAS 514220-96-3) is a chemical compound with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methylphenyl)-2,5-dimethylpyrazole-3-carboxamide
Also Known As: N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide, N-(3-chloro-4-methylphenyl)-2,5-dimethylpyrazole-3-carboxamide
| Molecular Formula | C13H14ClN3O |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 2.94264 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.08255 |
| Heavy Atoms | 18 |
| Complexity | 604.279 |
Chemical Identifiers
| CAS Number | 514220-96-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2=CC(=NN2C)C)Cl |
Product Overview
N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide (CAS 514220-96-3), with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-2,5-dimethylpyrazole-3-carboxamide.
Chemical Property Profile of N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
Property Insights of N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
The XLogP value of 2.94264 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide. With a topological polar surface area (TPSA) of 46.92 Ų, N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide has 1 hydrogen bond donor(s) and 2 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-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide?
The CAS number of N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide is 514220-96-3.
What is the molecular formula of N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide?
The molecular formula of N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide is C13H14ClN3O.
What is the molecular weight of N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide?
The molecular weight of N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide is 263.08 g/mol.
Where can I buy N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide?
You can request a quote for N-(3-chloro-4-methylphenyl)-1,3-dimethyl-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 N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-methylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.