[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](4-nitrophenyl)methanone
Chemical Structure Depiction of
[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](4-nitrophenyl)methanone
[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](4-nitrophenyl)methanone
Compound characteristics
Compound ID: | V002-7648 |
Compound Name: | [4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl](4-nitrophenyl)methanone |
Molecular Weight: | 477.58 |
Molecular Formula: | C25 H27 N5 O3 S |
Salt: | not_available |
Smiles: | C1CCc2c3c(nc(C4CC4)nc3sc2CC1)N1CCN(CC1)C(c1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.7456 |
logD: | 4.0207 |
logSw: | -5.93 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 73.641 |
InChI Key: | DRGMNAVCMDQHAL-UHFFFAOYSA-N |