2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 3807-1387 |
| Compound Name: | 2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 462.63 |
| Molecular Formula: | C26 H26 N2 O2 S2 |
| Smiles: | Cc1ccc(CSC2=Nc3c(C(N2c2ccccc2)=O)c2CC(C)(C)OCc2s3)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4351 |
| logD: | 6.4351 |
| logSw: | -5.6543 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.679 |
| InChI Key: | ZVQOWYKYPREQQC-UHFFFAOYSA-N |