N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-2-nitro-4-(trifluoromethyl)aniline
Chemical Structure Depiction of
N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-2-nitro-4-(trifluoromethyl)aniline
N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-2-nitro-4-(trifluoromethyl)aniline
Compound characteristics
| Compound ID: | 8014-8781 |
| Compound Name: | N-{2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}-2-nitro-4-(trifluoromethyl)aniline |
| Molecular Weight: | 469.46 |
| Molecular Formula: | C25 H22 F3 N3 O3 |
| Smiles: | Cc1c(CCNc2ccc(cc2[N+]([O-])=O)C(F)(F)F)c2cc(ccc2[nH]1)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4911 |
| logD: | 6.4911 |
| logSw: | -5.9325 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.851 |
| InChI Key: | XGSJQQLNXMXTDK-UHFFFAOYSA-N |