3-(4-ethylpiperazine-1-sulfonyl)-1-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-(4-ethylpiperazine-1-sulfonyl)-1-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid
3-(4-ethylpiperazine-1-sulfonyl)-1-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | P593-0443 |
| Compound Name: | 3-(4-ethylpiperazine-1-sulfonyl)-1-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C18 H24 N4 O4 S |
| Smiles: | CCN1CCN(CC1)S(c1c(cn(Cc2ccccc2C)n1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0979 |
| logD: | -1.722 |
| logSw: | -2.5408 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.721 |
| InChI Key: | JXFWGZMGJVZYQI-UHFFFAOYSA-N |