1-chloro-6-fluoro-2-[(2-nitrophenyl)sulfanyl]-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
Chemical Structure Depiction of
1-chloro-6-fluoro-2-[(2-nitrophenyl)sulfanyl]-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
1-chloro-6-fluoro-2-[(2-nitrophenyl)sulfanyl]-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
Compound characteristics
| Compound ID: | 4698-0807 |
| Compound Name: | 1-chloro-6-fluoro-2-[(2-nitrophenyl)sulfanyl]-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline |
| Molecular Weight: | 454.95 |
| Molecular Formula: | C24 H20 Cl F N2 O2 S |
| Smiles: | C1C2C(C(C1Sc1ccccc1[N+]([O-])=O)[Cl])c1cccc(c1NC2c1ccccc1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4645 |
| logD: | 6.4645 |
| logSw: | -6.2957 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.878 |
| InChI Key: | LZXBOXFPMAFGKF-UHFFFAOYSA-N |