3-butyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-butyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-butyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4159-0110 |
| Compound Name: | 3-butyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 294.44 |
| Molecular Formula: | C14 H18 N2 O S2 |
| Smiles: | CCCCN1C(=Nc2c(C1=O)c1CCCCc1s2)S |
| Stereo: | ACHIRAL |
| logP: | 3.8123 |
| logD: | 0.2301 |
| logSw: | -3.9419 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.6216 |
| InChI Key: | FQHRFCAVNFPVQV-UHFFFAOYSA-N |