2-methyl-1-[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one
Chemical Structure Depiction of
2-methyl-1-[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one
2-methyl-1-[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | V017-3782 |
| Compound Name: | 2-methyl-1-[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one |
| Molecular Weight: | 400.59 |
| Molecular Formula: | C22 H32 N4 O S |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2c3CCCCCc3sc2n1)N1CCN(CC1)C(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7155 |
| logD: | 5.2122 |
| logSw: | -5.4019 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.27 |
| InChI Key: | WMDLGVQSWMCIHR-UHFFFAOYSA-N |