9-[4-ethyl-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline
Chemical Structure Depiction of
9-[4-ethyl-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline
9-[4-ethyl-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline
Compound characteristics
| Compound ID: | V030-8216 |
| Compound Name: | 9-[4-ethyl-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2,3-dihydro-1H-cyclopenta[b]quinoline |
| Molecular Weight: | 454.52 |
| Molecular Formula: | C24 H21 F3 N4 S |
| Salt: | not_available |
| Smiles: | CCn1c(c2c3CCCc3nc3ccccc23)nnc1SCc1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.181 |
| logD: | 6.1796 |
| logSw: | -5.9272 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.084 |
| InChI Key: | AAKOCRMFKGEIKG-UHFFFAOYSA-N |