N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide
TL;DR: N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide (CAS 489407-62-7) is a chemical compound with molecular formula C15H18ClN3O and molecular weight 291.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide
Also Known As: BAS 08302930, N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide, N-(4-sec-butylphenyl)-4-chloro-1-methyl-1H-pyrazole-3-carboxamide, 4-Chloro-1-methyl-1H-pyrazole-3-carboxylic acid (4-sec-butyl-phenyl)-amide, N-[4-(butan-2-yl)phenyl]-4-chloro-1-methyl-1H-pyrazole-3-carboxamide
| Molecular Formula | C15H18ClN3O |
|---|---|
| Molecular Weight | 291.11 g/mol |
| LogP | 3.8393 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.11383 |
| Heavy Atoms | 20 |
| Complexity | 604.08124 |
Chemical Identifiers
| CAS Number | 489407-62-7 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)NC(=O)C2=NN(C=C2Cl)C |
Product Overview
N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide (CAS 489407-62-7), with molecular formula C15H18ClN3O and molecular weight 291.11 g/mol. IUPAC: N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide.
Chemical Property Profile of N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide
Property Insights of N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide
The XLogP value of 3.8393 indicates that N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-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-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide?
The CAS number of N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide is 489407-62-7.
What is the molecular formula of N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide?
The molecular formula of N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide is C15H18ClN3O.
What is the molecular weight of N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide?
The molecular weight of N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide is 291.11 g/mol.
Where can I buy N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide?
You can request a quote for N-(4-butan-2-ylphenyl)-4-chloro-1-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-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-butan-2-ylphenyl)-4-chloro-1-methylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.