N-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-2-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-2-carboxamide
N-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-2-carboxamide
Compound characteristics
| Compound ID: | 8008-9650 |
| Compound Name: | N-(4-bromophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-2-carboxamide |
| Molecular Weight: | 447.37 |
| Molecular Formula: | C25 H23 Br N2 O |
| Smiles: | C1C=CC2C1CN1CC3CC=CC3c3cc(cc2c13)C(Nc1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.5357 |
| logD: | 6.5121 |
| logSw: | -6.0776 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.6524 |
| InChI Key: | NUXIULFPJVAFPI-UHFFFAOYSA-N |