2-(butylsulfanyl)-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(butylsulfanyl)-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-(butylsulfanyl)-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3807-1351 |
| Compound Name: | 2-(butylsulfanyl)-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 348.53 |
| Molecular Formula: | C18 H24 N2 O S2 |
| Smiles: | CCCCSC1=Nc2c(C(N1CC(C)=C)=O)c1CCCCc1s2 |
| Stereo: | ACHIRAL |
| logP: | 5.627 |
| logD: | 5.627 |
| logSw: | -5.2315 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.137 |
| InChI Key: | GRWBFWGKRYSTAY-UHFFFAOYSA-N |