2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4333-3607 |
| Compound Name: | 2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 483.45 |
| Molecular Formula: | C23 H19 Br N2 O S2 |
| Smiles: | C1CCc2c(C1)c1C(N(C(=Nc1s2)SCc1ccc(cc1)[Br])c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0592 |
| logD: | 6.0592 |
| logSw: | -5.8152 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.9824 |
| InChI Key: | VJLZTLYUCQSORD-UHFFFAOYSA-N |