2-(ethylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(ethylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
2-(ethylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 8640-0458 |
| Compound Name: | 2-(ethylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 400.56 |
| Molecular Formula: | C21 H24 N2 O2 S2 |
| Smiles: | CCSC1=Nc2c(C(N1c1cccc(C)c1)=O)c1CC(C(C)C)OCc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4258 |
| logD: | 5.4258 |
| logSw: | -5.3828 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.606 |
| InChI Key: | HZDQYOCHDKNLSW-MRXNPFEDSA-N |