3-butyl-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-butyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-butyl-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: | 4159-0112 |
| Compound Name: | 3-butyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 334.5 |
| Molecular Formula: | C17 H22 N2 O S2 |
| Smiles: | CCCCN1C(=Nc2c(C1=O)c1CCCCc1s2)SCC=C |
| Stereo: | ACHIRAL |
| logP: | 4.9965 |
| logD: | 4.9965 |
| logSw: | -4.5821 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.1154 |
| InChI Key: | JWOXSKCBSSKVAR-UHFFFAOYSA-N |