(thiophen-2-yl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
Chemical Structure Depiction of
(thiophen-2-yl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
(thiophen-2-yl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
Compound characteristics
| Compound ID: | 2652-0657 |
| Compound Name: | (thiophen-2-yl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C21 H18 N4 O2 S |
| Smiles: | Cc1cc(C)c(C2=NON3N2c2ccccc2N3C(c2cccs2)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.7215 |
| logD: | 4.7215 |
| logSw: | -4.6673 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.093 |
| InChI Key: | QJATXPXGSDYLTK-UHFFFAOYSA-N |