3,3-dimethyl-1-[4-({2-(3-nitrophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl}methyl)piperazin-1-yl]butan-1-one
Chemical Structure Depiction of
3,3-dimethyl-1-[4-({2-(3-nitrophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl}methyl)piperazin-1-yl]butan-1-one
3,3-dimethyl-1-[4-({2-(3-nitrophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl}methyl)piperazin-1-yl]butan-1-one
Compound characteristics
| Compound ID: | V025-8460 |
| Compound Name: | 3,3-dimethyl-1-[4-({2-(3-nitrophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl}methyl)piperazin-1-yl]butan-1-one |
| Molecular Weight: | 579.62 |
| Molecular Formula: | C31 H32 F3 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N1CCN(CC1)Cc1c(c2cccc(c2)[N+]([O-])=O)nc2ccc(cn12)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5359 |
| logD: | 6.5353 |
| logSw: | -5.724 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.541 |
| InChI Key: | KWJMEJQKJAGIID-UHFFFAOYSA-N |