5-(azepan-1-yl)-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazoline
Chemical Structure Depiction of
5-(azepan-1-yl)-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazoline
5-(azepan-1-yl)-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazoline
Compound characteristics
| Compound ID: | C680-0597 |
| Compound Name: | 5-(azepan-1-yl)-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazoline |
| Molecular Weight: | 411.43 |
| Molecular Formula: | C22 H20 F3 N5 |
| Smiles: | C1CCCN(CC1)c1c2ccccc2n2c(c(c3cccc(c3)C(F)(F)F)nn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9357 |
| logD: | 5.9342 |
| logSw: | -6.6114 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 35.912 |
| InChI Key: | DUXRBNAEMWCEDA-UHFFFAOYSA-N |