1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y021-2216 |
| Compound Name: | 1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 512.02 |
| Molecular Formula: | C26 H32 F3 N3 O2 |
| Salt: | HCl |
| Smiles: | CC1CC(C)(C)N(C(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)c2ccc(cc12)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4991 |
| logD: | 4.4975 |
| logSw: | -4.4154 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.6049 |
| InChI Key: | XZFCCYUBVDNNQY-SFHVURJKSA-N |