N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-3-nitrobenzamide
N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-3-nitrobenzamide
Compound characteristics
Compound ID: | 8013-2273 |
Compound Name: | N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-3-nitrobenzamide |
Molecular Weight: | 407.35 |
Molecular Formula: | C19 H16 F3 N3 O4 |
Smiles: | Cc1c(CCNC(c2cccc(c2)[N+]([O-])=O)=O)c2cc(ccc2[nH]1)OC(F)(F)F |
Stereo: | ACHIRAL |
logP: | 4.4014 |
logD: | 4.4014 |
logSw: | -4.4612 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.738 |
InChI Key: | LVYDWCHLXYSJFI-UHFFFAOYSA-N |