1-methyl-5-{4-[(3-methylphenyl)methyl]piperazine-1-carbonyl}-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-methyl-5-{4-[(3-methylphenyl)methyl]piperazine-1-carbonyl}-1H-pyrazole-4-carboxylic acid
1-methyl-5-{4-[(3-methylphenyl)methyl]piperazine-1-carbonyl}-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6515 |
| Compound Name: | 1-methyl-5-{4-[(3-methylphenyl)methyl]piperazine-1-carbonyl}-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C18 H22 N4 O3 |
| Smiles: | Cc1cccc(CN2CCN(CC2)C(c2c(cnn2C)C(O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.6103 |
| logD: | -1.9645 |
| logSw: | -1.8175 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.351 |
| InChI Key: | QWVDYQYMFYHWGF-UHFFFAOYSA-N |