N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide
TL;DR: N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide (CAS 514840-24-5) is a chemical compound with molecular formula C15H18IN3O and molecular weight 383.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-butan-2-ylphenyl)-4-iodo-1-methylpyrazole-5-carboxamide
Also Known As: N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide, N-(2-sec-butylphenyl)-4-iodo-1-methyl-1H-pyrazole-5-carboxamide, N-[2-(butan-2-yl)phenyl]-4-iodo-1-methyl-1H-pyrazole-5-carboxamide, N-[2-(SEC-BUTYL)PHENYL]-4-IODO-1-METHYL-1H-PYRAZOLE-5-CARBOXAMIDE
| Molecular Formula | C15H18IN3O |
|---|---|
| Molecular Weight | 383.05 g/mol |
| LogP | 3.7905 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.04947 |
| Heavy Atoms | 20 |
| Complexity | 601.83124 |
Chemical Identifiers
| CAS Number | 514840-24-5 |
|---|---|
| SMILES | CCC(C)C1=CC=CC=C1NC(=O)C2=C(C=NN2C)I |
Product Overview
N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide (CAS 514840-24-5), with molecular formula C15H18IN3O and molecular weight 383.05 g/mol. IUPAC: N-(2-butan-2-ylphenyl)-4-iodo-1-methylpyrazole-5-carboxamide.
Chemical Property Profile of N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide
Property Insights of N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide
The XLogP value of 3.7905 indicates that N-(2-butan-2-ylphenyl)-4-iodo-2-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-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-butan-2-ylphenyl)-4-iodo-2-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-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide?
The CAS number of N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide is 514840-24-5.
What is the molecular formula of N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide?
The molecular formula of N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide is C15H18IN3O.
What is the molecular weight of N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide?
The molecular weight of N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide is 383.05 g/mol.
Where can I buy N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide?
You can request a quote for N-(2-butan-2-ylphenyl)-4-iodo-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-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-butan-2-ylphenyl)-4-iodo-2-methylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.