N-[2-(1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline
N-[2-(1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline
Compound characteristics
| Compound ID: | 6304-0012 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-2-nitro-4-(trifluoromethyl)aniline |
| Molecular Weight: | 349.31 |
| Molecular Formula: | C17 H14 F3 N3 O2 |
| Smiles: | C(CNc1ccc(cc1[N+]([O-])=O)C(F)(F)F)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.6979 |
| logD: | 4.6979 |
| logSw: | -4.879 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.568 |
| InChI Key: | OLVOOKVBWQEOMH-UHFFFAOYSA-N |