1-[4-(2-benzyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one
Chemical Structure Depiction of
1-[4-(2-benzyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one
1-[4-(2-benzyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one
Compound characteristics
| Compound ID: | V030-8978 |
| Compound Name: | 1-[4-(2-benzyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]heptan-1-one |
| Molecular Weight: | 490.71 |
| Molecular Formula: | C29 H38 N4 O S |
| Salt: | not_available |
| Smiles: | CCCCCCC(N1CCN(CC1)c1c2c3CCCCCc3sc2nc(Cc2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.6196 |
| logD: | 7.4975 |
| logSw: | -5.9328 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.471 |
| InChI Key: | ZTWVCECMEPRMHN-UHFFFAOYSA-N |