2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 3993-2593 |
| Compound Name: | 2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C24 H20 N2 O3 S2 |
| Smiles: | COc1ccc(cc1)C(CSC1=Nc2c(C(N1c1ccccc1)=O)c1CCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6001 |
| logD: | 4.6001 |
| logSw: | -4.6196 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.139 |
| InChI Key: | ULVLRNXWUZQHSC-UHFFFAOYSA-N |