3-[4-(ethanesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-[4-(ethanesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
3-[4-(ethanesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-5744 |
| Compound Name: | 3-[4-(ethanesulfonyl)piperazine-1-carbonyl]-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 330.36 |
| Molecular Formula: | C12 H18 N4 O5 S |
| Smiles: | CCS(N1CCN(CC1)C(c1c(cn(C)n1)C(O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.8591 |
| logD: | -4.4338 |
| logSw: | -1.5119 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.335 |
| InChI Key: | OTTKGXKQUYIAKU-UHFFFAOYSA-N |