2-{[rel-(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-N-[3-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-indol-5-yl]acetamide
Chemical Structure Depiction of
2-{[rel-(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-N-[3-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-indol-5-yl]acetamide
2-{[rel-(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-N-[3-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-indol-5-yl]acetamide
Compound characteristics
| Compound ID: | V005-9052 |
| Compound Name: | 2-{[rel-(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-N-[3-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-indol-5-yl]acetamide |
| Molecular Weight: | 584.73 |
| Molecular Formula: | C33 H43 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(Nc1ccc2c(c1)c(CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)c[nH]2)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 7.4243 |
| logD: | 7.2256 |
| logSw: | -5.802 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.106 |
| InChI Key: | ULIKCZMPVPEXBG-LAJKQIPCSA-N |