7-methyl-3-phenyl-2-sulfanylidene-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-methyl-3-phenyl-2-sulfanylidene-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
7-methyl-3-phenyl-2-sulfanylidene-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 3993-1999 |
| Compound Name: | 7-methyl-3-phenyl-2-sulfanylidene-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 328.45 |
| Molecular Formula: | C17 H16 N2 O S2 |
| Smiles: | CC1CCc2c3C(N(C(Nc3sc2C1)=S)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0591 |
| logD: | 3.4355 |
| logSw: | -4.301 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.5293 |
| InChI Key: | IVSIHDBMSUYSAH-SNVBAGLBSA-N |