4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)
TL;DR: 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) (CAS 2014398-44-6) is a chemical compound with molecular formula C16H18N4O2 and molecular weight 298.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]-1,2-dihydropyrazol-3-one
Also Known As: BAS 03349249, J3.671.219H, 4,4'-(p-tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol), 4,4 -(4-Methylbenzylidene)bis(3-methyl-1H-pyrazole-5-ol), 4,4'-[(4-methylphenyl)methanediyl]bis(3-methyl-1H-pyrazol-5-ol)
| Molecular Formula | C16H18N4O2 |
|---|---|
| Molecular Weight | 298.14 g/mol |
| LogP | 1.82486 |
| Topological Polar Surface Area | 97.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.14297 |
| Heavy Atoms | 22 |
| Complexity | 854.51666 |
Chemical Identifiers
| CAS Number | 2014398-44-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C2=C(NNC2=O)C)C3=C(NNC3=O)C |
Product Overview
4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) (CAS 2014398-44-6), with molecular formula C16H18N4O2 and molecular weight 298.14 g/mol. IUPAC: 5-methyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]-1,2-dihydropyrazol-3-one.
Chemical Property Profile of 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)
Property Insights of 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)
The XLogP value of 1.82486 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol). The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol). Following Lipinski's Rule of Five, 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) has 4 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 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)?
The CAS number of 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) is 2014398-44-6.
What is the molecular formula of 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)?
The molecular formula of 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) is C16H18N4O2.
What is the molecular weight of 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)?
The molecular weight of 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) is 298.14 g/mol.
Where can I buy 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)?
You can request a quote for 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-(p-Tolylmethylene)bis(3-methyl-1h-pyrazol-5-ol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.