TL;DR: 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide (CAS 1095909-44-6) is a chemical compound with molecular formula C19H19N3O2 and molecular weight 321.14774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-hydroxy-4-methylphenyl)-N-[(4-methylphenyl)methyl]-1H-pyrazole-5-carboxamide
Also Known As: 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide, 3-(2-hydroxy-4-methylphenyl)-N-[(4-methylphenyl)methyl]-1H-pyrazole-5-carboxamide, 5-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-3-carboxamide, (5Z)-5-(4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[(4-methylphenyl)methyl]-1,2-dihydropyrazole-3-carboxamide, 5-(4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[(4-methylphenyl)methyl]-1,2-dihydropyrazole-3-carboxamide
| Molecular Formula | C19H19N3O2 |
| Molecular Weight | 321.14774 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 78.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.14774 Da |
| Heavy Atoms | 24 |
| Complexity | 423.0 |
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=CC(=NN2)C3=C(C=C(C=C3)C)O |
| InChIKey | PATBFLINEPLPAH-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide is 1095909-44-6.
The molecular formula of 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide is C19H19N3O2.
The molecular weight of 3-(2-hydroxy-4-methylphenyl)-N-(4-methylbenzyl)-1H-pyrazole-5-carboxamide is 321.14774 g/mol.
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