rel-(3aR,4S,9bS)-N-(2,4-dimethylphenyl)-4-(3-methoxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
Chemical Structure Depiction of
rel-(3aR,4S,9bS)-N-(2,4-dimethylphenyl)-4-(3-methoxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
rel-(3aR,4S,9bS)-N-(2,4-dimethylphenyl)-4-(3-methoxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
Compound characteristics
| Compound ID: | 5408-1403 |
| Compound Name: | rel-(3aR,4S,9bS)-N-(2,4-dimethylphenyl)-4-(3-methoxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide |
| Molecular Weight: | 460.59 |
| Molecular Formula: | C27 H28 N2 O3 S |
| Smiles: | [H][C@@]12C=CC[C@@]2([H])[C@@H](c2cccc(c2)OC)Nc2ccc(cc12)S(Nc1ccc(C)cc1C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.25 |
| logD: | 6.2448 |
| logSw: | -5.6014 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.817 |
| InChI Key: | KOHIICOZPPIQPX-WCYRKSIYSA-N |