2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3473-0289 |
| Compound Name: | 2-{[(4-bromophenyl)methyl]sulfanyl}-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 526.52 |
| Molecular Formula: | C25 H24 Br N3 O S2 |
| Smiles: | CCCN1CCc2c3C(N(C(=Nc3sc2C1)SCc1ccc(cc1)[Br])c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7393 |
| logD: | 5.7243 |
| logSw: | -5.4906 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 28.7062 |
| InChI Key: | WSVAWLMBGCSEKS-UHFFFAOYSA-N |