(8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolin-5-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolin-5-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
(8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolin-5-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V006-2982 |
| Compound Name: | (8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolin-5-yl){4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 488.51 |
| Molecular Formula: | C25 H27 F3 N4 O3 |
| Smiles: | C1CCN2C(C1)C(Cc1cc(ccc12)[N+]([O-])=O)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3809 |
| logD: | 4.3809 |
| logSw: | -4.4452 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.9 |
| InChI Key: | BMKSFTJFWBQCDM-UHFFFAOYSA-N |