7-(4-bromophenyl)-2-(trifluoromethyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
Chemical Structure Depiction of
7-(4-bromophenyl)-2-(trifluoromethyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
7-(4-bromophenyl)-2-(trifluoromethyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
Compound characteristics
| Compound ID: | Y020-9572 |
| Compound Name: | 7-(4-bromophenyl)-2-(trifluoromethyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one |
| Molecular Weight: | 411.14 |
| Molecular Formula: | C14 H6 Br F3 N6 O |
| Smiles: | C1=CN(C(C2=C1n1c(N=N2)nc(C(F)(F)F)n1)=O)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.6394 |
| logD: | 3.6394 |
| logSw: | -3.9155 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.108 |
| InChI Key: | ROZCCAYOEUBAEW-UHFFFAOYSA-N |