3-benzyl-2-{[(4-bromophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[(4-bromophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-benzyl-2-{[(4-bromophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4333-3610 |
| Compound Name: | 3-benzyl-2-{[(4-bromophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 497.47 |
| Molecular Formula: | C24 H21 Br N2 O S2 |
| Smiles: | C1CCc2c(C1)c1C(N(Cc3ccccc3)C(=Nc1s2)SCc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.6542 |
| logD: | 6.6542 |
| logSw: | -5.955 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.5939 |
| InChI Key: | VYNVOQVTZJZQCI-UHFFFAOYSA-N |