1-{1-[4-(propan-2-yl)benzene-1-sulfonyl]piperidin-4-yl}-4-(prop-2-en-1-yl)piperazine-2,3-dione
Chemical Structure Depiction of
1-{1-[4-(propan-2-yl)benzene-1-sulfonyl]piperidin-4-yl}-4-(prop-2-en-1-yl)piperazine-2,3-dione
1-{1-[4-(propan-2-yl)benzene-1-sulfonyl]piperidin-4-yl}-4-(prop-2-en-1-yl)piperazine-2,3-dione
Compound characteristics
| Compound ID: | F117-0285 |
| Compound Name: | 1-{1-[4-(propan-2-yl)benzene-1-sulfonyl]piperidin-4-yl}-4-(prop-2-en-1-yl)piperazine-2,3-dione |
| Molecular Weight: | 419.54 |
| Molecular Formula: | C21 H29 N3 O4 S |
| Smiles: | CC(C)c1ccc(cc1)S(N1CCC(CC1)N1CCN(CC=C)C(C1=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0498 |
| logD: | 3.0498 |
| logSw: | -3.3023 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.439 |
| InChI Key: | FRHZEMVZBITRQO-UHFFFAOYSA-N |