(2H-1,3-benzodioxol-5-yl)[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]methanone
(2H-1,3-benzodioxol-5-yl)[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | F897-0665 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]methanone |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C18 H22 N4 O5 S |
| Smiles: | Cc1c(c(C)n(C)n1)S(N1CCN(CC1)C(c1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1128 |
| logD: | 0.1128 |
| logSw: | -2.1528 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.36 |
| InChI Key: | GJSCSEVQYQZVPP-UHFFFAOYSA-N |