3-benzyl-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
3-benzyl-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
3-benzyl-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 2969-0101 |
| Compound Name: | 3-benzyl-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 314.43 |
| Molecular Formula: | C16 H14 N2 O S2 |
| Smiles: | C1Cc2c3C(N(Cc4ccccc4)C(=Nc3sc2C1)S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7405 |
| logD: | -0.2735 |
| logSw: | -4.2938 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.7376 |
| InChI Key: | SCOOEYHUMCRCSK-UHFFFAOYSA-N |