9-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8-phenyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
9-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8-phenyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
9-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8-phenyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 3966-1000 |
| Compound Name: | 9-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8-phenyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 515.05 |
| Molecular Formula: | C28 H19 Cl N2 O2 S2 |
| Smiles: | C1Cc2c3C(N(C(=Nc3sc2c2ccccc12)SCC(c1ccc(cc1)[Cl])=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6195 |
| logD: | 6.6191 |
| logSw: | -6.4412 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.958 |
| InChI Key: | JAZVSAVQNPHIFX-UHFFFAOYSA-N |