N-(2-{[3-(propylsulfanyl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(2-{[3-(propylsulfanyl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(2-{[3-(propylsulfanyl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0970F |
| Compound Name: | N-(2-{[3-(propylsulfanyl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 380.53 |
| Molecular Formula: | C18 H24 N2 O3 S2 |
| Smiles: | CCCSCCCNC(c1ccccc1NC(C1=CSCCO1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4987 |
| logD: | 2.2696 |
| logSw: | -2.9844 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.787 |
| InChI Key: | QYWMYVCEAVPKCF-UHFFFAOYSA-N |