TL;DR: 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide (CAS 1005615-48-4) is a chemical compound with molecular formula C13H14N4O2 and molecular weight 258.11166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-4-[(2-methylbenzoyl)amino]pyrazole-3-carboxamide
Also Known As: 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide, 1-methyl-4-[(2-methylbenzoyl)amino]pyrazole-3-carboxamide, 1-Methyl-4-(2-methylbenzamido)-1H-pyrazole-3-carboxamide, 1-methyl-4-{[(2-methylphenyl)carbonyl]amino}-1H-pyrazole-3-carboxamide
| Molecular Formula | C13H14N4O2 |
| Molecular Weight | 258.11166 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 90.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.11166 Da |
| Heavy Atoms | 19 |
| Complexity | 361.0 |
| SMILES | CC1=CC=CC=C1C(=O)NC2=CN(N=C2C(=O)N)C |
| InChIKey | OAACBSWSJRHLDW-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide has 2 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 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide is 1005615-48-4.
The molecular formula of 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide is C13H14N4O2.
The molecular weight of 1-Methyl-4-[(2-methylbenzoyl)amino]-1H-pyrazole-3-carboxamide is 258.11166 g/mol.
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