[4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](3-nitrophenyl)methanone
Chemical Structure Depiction of
[4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](3-nitrophenyl)methanone
[4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | V002-7637 |
| Compound Name: | [4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](3-nitrophenyl)methanone |
| Molecular Weight: | 519.67 |
| Molecular Formula: | C28 H33 N5 O3 S |
| Salt: | not_available |
| Smiles: | C1CCC(CC1)c1nc(c2c3CCCCCc3sc2n1)N1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8844 |
| logD: | 6.2177 |
| logSw: | -6.2285 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.31 |
| InChI Key: | DKMICENZHZNGKK-UHFFFAOYSA-N |