(4-benzoylphenyl)[3-(3,5-dichloro-2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
Chemical Structure Depiction of
(4-benzoylphenyl)[3-(3,5-dichloro-2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
(4-benzoylphenyl)[3-(3,5-dichloro-2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone
Compound characteristics
| Compound ID: | 0934-1231 |
| Compound Name: | (4-benzoylphenyl)[3-(3,5-dichloro-2,4,6-trimethylphenyl)-9H-[1,2,3,5]oxatriazolo[3,2-a]benzotriazol-9-yl]methanone |
| Molecular Weight: | 557.44 |
| Molecular Formula: | C30 H22 Cl2 N4 O3 |
| Smiles: | Cc1c(C2=NON3N2c2ccccc2N3C(c2ccc(cc2)C(c2ccccc2)=O)=O)c(C)c(c(C)c1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.002 |
| logD: | 7.002 |
| logSw: | -6.6034 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.542 |
| InChI Key: | CECFNZAZCAXJCZ-UHFFFAOYSA-N |