1-[7-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinolin-2-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinolin-2-yl]ethan-1-one
1-[7-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinolin-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | 2155-0010 |
| Compound Name: | 1-[7-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinolin-2-yl]ethan-1-one |
| Molecular Weight: | 446.39 |
| Molecular Formula: | C26 H24 Br N O |
| Smiles: | CC(c1cc2C3C=CCC3CN3C(C4CC=CC4c(c1)c23)c1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.7878 |
| logD: | 6.7878 |
| logSw: | -5.5799 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 18.0569 |
| InChI Key: | XMOGORDPIWNJPL-UHFFFAOYSA-N |