N-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0726 |
| Compound Name: | N-{2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C22 H22 F N3 O3 S |
| Smiles: | C1CN(CCN1C(c1ccccc1NC(C1=CSCCO1)=O)=O)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 2.8758 |
| logD: | 2.3446 |
| logSw: | -3.775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.868 |
| InChI Key: | WWVGPIYSPZEUCI-UHFFFAOYSA-N |