7-tert-butyl-3-(2-methylprop-2-en-1-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-tert-butyl-3-(2-methylprop-2-en-1-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
7-tert-butyl-3-(2-methylprop-2-en-1-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3683-0034 |
| Compound Name: | 7-tert-butyl-3-(2-methylprop-2-en-1-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 466.66 |
| Molecular Formula: | C26 H30 N2 O2 S2 |
| Smiles: | CC(=C)CN1C(=Nc2c(C1=O)c1CCC(Cc1s2)C(C)(C)C)SCC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5637 |
| logD: | 6.5637 |
| logSw: | -5.7421 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.112 |
| InChI Key: | WTZUQIVLMDTIDY-GOSISDBHSA-N |