![5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole structure](/static/products/957/957513-92-7.png)
5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
TL;DR: 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole (CAS 957513-92-7) is a chemical compound with molecular formula C13H11IN4O and molecular weight 366.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
Also Known As: 5-[(4-Iodo-1H-pyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole, 5-[(4-iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
| Molecular Formula | C13H11IN4O |
|---|---|
| Molecular Weight | 366.00 g/mol |
| LogP | 2.89442 |
| Topological Polar Surface Area | 56.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.99777 |
| Heavy Atoms | 19 |
| Complexity | 686.7485 |
Chemical Identifiers
| CAS Number | 957513-92-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NOC(=N2)CN3C=C(C=N3)I |
Product Overview
5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole (CAS 957513-92-7), with molecular formula C13H11IN4O and molecular weight 366.00 g/mol. IUPAC: 5-[(4-iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
Property Insights of 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
The XLogP value of 2.89442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole. With a topological polar surface area (TPSA) of 56.74 Ų, 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 4 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 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole?
The CAS number of 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole is 957513-92-7.
What is the molecular formula of 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole?
The molecular formula of 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole is C13H11IN4O.
What is the molecular weight of 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole?
The molecular weight of 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole is 366.00 g/mol.
Where can I buy 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole?
You can request a quote for 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Iodopyrazol-1-yl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.