2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-(3,4,5-trimethylphenyl)ethan-1-one
Chemical Structure Depiction of
2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-(3,4,5-trimethylphenyl)ethan-1-one
2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-(3,4,5-trimethylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | 5055-7335 |
| Compound Name: | 2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-(3,4,5-trimethylphenyl)ethan-1-one |
| Molecular Weight: | 382.55 |
| Molecular Formula: | C21 H22 N2 O S2 |
| Smiles: | Cc1cc(cc(C)c1C)C(CSc1c2c3CCCCc3sc2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1157 |
| logD: | 6.1157 |
| logSw: | -5.6166 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.181 |
| InChI Key: | XGSYYOWLNAUPJT-UHFFFAOYSA-N |