1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-phenylprop-2-en-1-one
Chemical Structure Depiction of
1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-phenylprop-2-en-1-one
1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-phenylprop-2-en-1-one
Compound characteristics
| Compound ID: | V008-7730 |
| Compound Name: | 1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-phenylprop-2-en-1-one |
| Molecular Weight: | 458.63 |
| Molecular Formula: | C27 H30 N4 O S |
| Salt: | not_available |
| Smiles: | C1CCc2c3c(nc(C4CC4)nc3sc2CC1)N1CCN(CC1)C(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5209 |
| logD: | 4.796 |
| logSw: | -6.1303 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.732 |
| InChI Key: | WIIHGNOUPYXZFB-UHFFFAOYSA-N |