1-benzyl-3-[4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-benzyl-3-[4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylic acid
1-benzyl-3-[4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | P593-0524 |
| Compound Name: | 1-benzyl-3-[4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C22 H24 N4 O4 S |
| Smiles: | Cc1cccc(c1)N1CCN(CC1)S(c1c(cn(Cc2ccccc2)n1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2255 |
| logD: | -0.5944 |
| logSw: | -3.2732 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.445 |
| InChI Key: | HEWXTGBMGSIQAU-UHFFFAOYSA-N |