5-[4-(benzenesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-[4-(benzenesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
5-[4-(benzenesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6059 |
| Compound Name: | 5-[4-(benzenesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 378.4 |
| Molecular Formula: | C16 H18 N4 O5 S |
| Smiles: | Cn1c(C(N2CCN(CC2)S(c2ccccc2)(=O)=O)=O)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.525 |
| logD: | -3.0497 |
| logSw: | -2.2998 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.329 |
| InChI Key: | GMJXJLAESVTGJZ-UHFFFAOYSA-N |