3-(4-phenylpiperazine-1-sulfonyl)-1-[(pyridin-2-yl)methyl]-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-(4-phenylpiperazine-1-sulfonyl)-1-[(pyridin-2-yl)methyl]-1H-pyrazole-4-carboxylic acid
3-(4-phenylpiperazine-1-sulfonyl)-1-[(pyridin-2-yl)methyl]-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | P593-0512 |
| Compound Name: | 3-(4-phenylpiperazine-1-sulfonyl)-1-[(pyridin-2-yl)methyl]-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C20 H21 N5 O4 S |
| Smiles: | C1CN(CCN1c1ccccc1)S(c1c(cn(Cc2ccccn2)n1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6655 |
| logD: | -2.1544 |
| logSw: | -2.4873 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.988 |
| InChI Key: | PXWFJHHZYMWPTQ-UHFFFAOYSA-N |