1-[4-(4-{7-chloro-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-yl}piperazin-1-yl)phenyl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-{7-chloro-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-yl}piperazin-1-yl)phenyl]ethan-1-one
1-[4-(4-{7-chloro-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-yl}piperazin-1-yl)phenyl]ethan-1-one
Compound characteristics
Compound ID: | C680-0808 |
Compound Name: | 1-[4-(4-{7-chloro-3-[3-(trifluoromethyl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-yl}piperazin-1-yl)phenyl]ethan-1-one |
Molecular Weight: | 550.97 |
Molecular Formula: | C28 H22 Cl F3 N6 O |
Smiles: | CC(c1ccc(cc1)N1CCN(CC1)c1c2cc(ccc2n2c(c(c3cccc(c3)C(F)(F)F)nn2)n1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 6.5381 |
logD: | 6.538 |
logSw: | -6.4362 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 52.668 |
InChI Key: | QPYBZTNBQKIATF-UHFFFAOYSA-N |