N-benzyl-3-[4-(2-ethoxyphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-3-[4-(2-ethoxyphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carboxamide
N-benzyl-3-[4-(2-ethoxyphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-5391 |
| Compound Name: | N-benzyl-3-[4-(2-ethoxyphenyl)piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C24 H29 N5 O4 S |
| Smiles: | CCOc1ccccc1N1CCN(CC1)S(c1c(cn(C)n1)C(NCc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7898 |
| logD: | 2.7896 |
| logSw: | -3.5842 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.663 |
| InChI Key: | XWFLTXKCYKNHBL-UHFFFAOYSA-N |