![1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole structure](/static/products/1005/1005558-54-2.webp)
1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole
TL;DR: 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole (CAS 1005558-54-2) is a chemical compound with molecular formula C12H12N6 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]tetrazole
Also Known As: 1-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]tetrazole, 1-[1-(2-methylbenzyl)-1H-pyrazol-3-yl]-1H-tetrazole, 1-{1-[(2-methylphenyl)methyl]pyrazol-3-yl}-1,2,3,4-tetraazole, 1-[1-(2-METHYLBENZYL)-1H-PYRAZOL-3-YL]-1H-1,2,3,4-TETRAAZOLE
| Molecular Formula | C12H12N6 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 1.21552 |
| Topological Polar Surface Area | 61.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.11235 |
| Heavy Atoms | 18 |
| Complexity | 640.1536 |
Chemical Identifiers
| CAS Number | 1005558-54-2 |
|---|---|
| SMILES | CC1=CC=CC=C1CN2C=CC(=N2)N3C=NN=N3 |
Product Overview
1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole (CAS 1005558-54-2), with molecular formula C12H12N6 and molecular weight 240.11 g/mol. IUPAC: 1-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]tetrazole.
Chemical Property Profile of 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole
Property Insights of 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole
The XLogP value of 1.21552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole. The TPSA of 61.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole. Following Lipinski's Rule of Five, 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole 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 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole?
The CAS number of 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole is 1005558-54-2.
What is the molecular formula of 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole?
The molecular formula of 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole is C12H12N6.
What is the molecular weight of 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole?
The molecular weight of 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole is 240.11 g/mol.
Where can I buy 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole?
You can request a quote for 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-[(2-Methylphenyl)methyl]pyrazol-3-yl]tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.