2-(benzylsulfanyl)-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
2-(benzylsulfanyl)-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 8640-0376 |
| Compound Name: | 2-(benzylsulfanyl)-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 464.67 |
| Molecular Formula: | C25 H24 N2 O S3 |
| Smiles: | Cc1cccc(c1)N1C(=Nc2c(C1=O)c1CC(C)(C)SCc1s2)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3522 |
| logD: | 6.3522 |
| logSw: | -5.5889 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 24.9824 |
| InChI Key: | HKLSMKWKWSQYIP-UHFFFAOYSA-N |