1-[4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one
Chemical Structure Depiction of
1-[4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one
1-[4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one
Compound characteristics
| Compound ID: | V009-0002 |
| Compound Name: | 1-[4-(2-benzyl-7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3,3-dimethylbutan-1-one |
| Molecular Weight: | 491.7 |
| Molecular Formula: | C28 H37 N5 O S |
| Salt: | not_available |
| Smiles: | CCN1CCc2c3c(nc(Cc4ccccc4)nc3sc2C1)N1CCN(CC1)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7691 |
| logD: | 5.6918 |
| logSw: | -5.7102 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.61 |
| InChI Key: | ZOAQWGFQKHWNFK-UHFFFAOYSA-N |