2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(2-phenylethyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(2-phenylethyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(2-phenylethyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4386-0411 |
| Compound Name: | 2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(2-phenylethyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 446.59 |
| Molecular Formula: | C25 H22 N2 O2 S2 |
| Smiles: | C1Cc2c3C(N(CCc4ccccc4)C(=Nc3sc2C1)SCC(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2068 |
| logD: | 5.2068 |
| logSw: | -5.4288 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.185 |
| InChI Key: | OOKPOCAJIJLIDC-UHFFFAOYSA-N |