3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3379-1786 |
| Compound Name: | 3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 368.52 |
| Molecular Formula: | C20 H20 N2 O S2 |
| Smiles: | Cc1ccc(cc1)N1C(=Nc2c(C1=O)c1CCCCc1s2)SCC=C |
| Stereo: | ACHIRAL |
| logP: | 5.2848 |
| logD: | 5.2848 |
| logSw: | -5.1806 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.254 |
| InChI Key: | VLRNIHYVMWWXKW-UHFFFAOYSA-N |