methyl 4-(8-bromo-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate
Chemical Structure Depiction of
methyl 4-(8-bromo-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate
methyl 4-(8-bromo-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate
Compound characteristics
| Compound ID: | 8008-3340 |
| Compound Name: | methyl 4-(8-bromo-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzoate |
| Molecular Weight: | 384.27 |
| Molecular Formula: | C20 H18 Br N O2 |
| Smiles: | COC(c1ccc(cc1)C1C2CC=CC2c2cc(ccc2N1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5937 |
| logD: | 5.5937 |
| logSw: | -5.5039 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.495 |
| InChI Key: | MAPLJDVVHBOMAU-UHFFFAOYSA-N |