N-butyl-7-chloro-N-ethyl-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-butyl-7-chloro-N-ethyl-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-butyl-7-chloro-N-ethyl-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C680-0813 |
| Compound Name: | N-butyl-7-chloro-N-ethyl-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 447.89 |
| Molecular Formula: | C22 H21 Cl F3 N5 |
| Smiles: | CCCCN(CC)c1c2cc(ccc2n2c(c(c3cccc(c3)C(F)(F)F)nn2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.9158 |
| logD: | 6.9149 |
| logSw: | -6.7339 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 35.118 |
| InChI Key: | AWENSZKXLXUTAT-UHFFFAOYSA-N |