(4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone
TL;DR: (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone (CAS 514217-48-2) is a chemical compound with molecular formula C8H7IN4O and molecular weight 301.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone
Also Known As: (4-iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone, 4-iodo-1-methylpyrazol-3-yl pyrazolyl ketone, 4-iodo-1-methyl-3-(1H-pyrazol-1-ylcarbonyl)-1H-pyrazole, (4-iodo-1-methyl-1H-pyrazol-3-yl)(1H-pyrazol-1-yl)methanone
| Molecular Formula | C8H7IN4O |
|---|---|
| Molecular Weight | 301.97 g/mol |
| LogP | 0.9097 |
| Topological Polar Surface Area | 52.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.96646 |
| Heavy Atoms | 14 |
| Complexity | 459.6496 |
Chemical Identifiers
| CAS Number | 514217-48-2 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)N2C=CC=N2)I |
Product Overview
(4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone (CAS 514217-48-2), with molecular formula C8H7IN4O and molecular weight 301.97 g/mol. IUPAC: (4-iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone.
Chemical Property Profile of (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone
Property Insights of (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone
The XLogP value of 0.9097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone. With a topological polar surface area (TPSA) of 52.71 Ų, (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone has 0 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 (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone?
The CAS number of (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone is 514217-48-2.
What is the molecular formula of (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone?
The molecular formula of (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone is C8H7IN4O.
What is the molecular weight of (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone?
The molecular weight of (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone is 301.97 g/mol.
Where can I buy (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone?
You can request a quote for (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Iodo-1-methylpyrazol-3-yl)-pyrazol-1-ylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.