[4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl][3-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
[4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl][3-(trifluoromethyl)phenyl]methanone
[4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl][3-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V009-0014 |
| Compound Name: | [4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl][3-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 565.66 |
| Molecular Formula: | C30 H30 F3 N5 O S |
| Salt: | not_available |
| Smiles: | CCN1CCc2c3c(nc(Cc4ccccc4)nc3sc2C1)N1CCN(CC1)C(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0118 |
| logD: | 5.9345 |
| logSw: | -5.9545 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.866 |
| InChI Key: | FLFQWCDKOKJAJQ-UHFFFAOYSA-N |