6,6-dimethyl-3-(2-methylphenyl)-2-[(2-phenylethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
6,6-dimethyl-3-(2-methylphenyl)-2-[(2-phenylethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
6,6-dimethyl-3-(2-methylphenyl)-2-[(2-phenylethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 5627-0050 |
| Compound Name: | 6,6-dimethyl-3-(2-methylphenyl)-2-[(2-phenylethyl)sulfanyl]-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: | Cc1ccccc1N1C(=Nc2c(C1=O)c1CC(C)(C)OCc1s2)SCCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.311 |
| logD: | 6.311 |
| logSw: | -5.5472 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.379 |
| InChI Key: | RGDSHUOLEBDPAM-UHFFFAOYSA-N |