1-benzyl-3-(4-methylpiperidine-1-sulfonyl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-benzyl-3-(4-methylpiperidine-1-sulfonyl)-1H-pyrazole-4-carboxylic acid
1-benzyl-3-(4-methylpiperidine-1-sulfonyl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | P593-0233 |
| Compound Name: | 1-benzyl-3-(4-methylpiperidine-1-sulfonyl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 363.43 |
| Molecular Formula: | C17 H21 N3 O4 S |
| Smiles: | CC1CCN(CC1)S(c1c(cn(Cc2ccccc2)n1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5354 |
| logD: | -1.2844 |
| logSw: | -2.6353 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.185 |
| InChI Key: | LUVOUMVBPHBQFJ-UHFFFAOYSA-N |