(2,4-dinitrophenyl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
Chemical Structure Depiction of
(2,4-dinitrophenyl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
(2,4-dinitrophenyl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
Compound characteristics
| Compound ID: | 2652-0658 |
| Compound Name: | (2,4-dinitrophenyl)[3-(2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone |
| Molecular Weight: | 474.43 |
| Molecular Formula: | C23 H18 N6 O6 |
| Smiles: | Cc1cc(C)c(C2=NON3N2c2ccccc2N3C(c2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3818 |
| logD: | 4.3818 |
| logSw: | -4.5751 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 115.537 |
| InChI Key: | VUXZXQQKUIICAX-UHFFFAOYSA-N |