N-(2,4-difluorophenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-(2,4-difluorophenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
Compound ID: | E694-0051 |
Compound Name: | N-(2,4-difluorophenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
Molecular Weight: | 451.45 |
Molecular Formula: | C22 H15 F2 N5 O2 S |
Smiles: | Cc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)Nc1ccc(cc1F)F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.253 |
logD: | 5.253 |
logSw: | -5.4096 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.597 |
InChI Key: | KJZUFWCECGEFFY-UHFFFAOYSA-N |