3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1-methyl-N-(prop-2-en-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1-methyl-N-(prop-2-en-1-yl)-1H-pyrazole-4-carboxamide
3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1-methyl-N-(prop-2-en-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-4214 |
| Compound Name: | 3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1-methyl-N-(prop-2-en-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C20 H27 N5 O3 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)S(c1c(cn(C)n1)C(NCC=C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3135 |
| logD: | 2.3134 |
| logSw: | -2.8792 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.566 |
| InChI Key: | JHMSQXSDVPSVDR-UHFFFAOYSA-N |