N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(trifluoromethoxy)aniline
Chemical Structure Depiction of
N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(trifluoromethoxy)aniline
N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(trifluoromethoxy)aniline
Compound characteristics
| Compound ID: | K630-0042 |
| Compound Name: | N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-(trifluoromethoxy)aniline |
| Molecular Weight: | 406.2 |
| Molecular Formula: | C16 H15 Br F3 N O3 |
| Smiles: | COc1cc(c(cc1CNc1ccc(cc1)OC(F)(F)F)[Br])OC |
| Stereo: | ACHIRAL |
| logP: | 5.4008 |
| logD: | 5.4008 |
| logSw: | -5.5458 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.67 |
| InChI Key: | YHTIZTGSEQVMJT-UHFFFAOYSA-N |