12-[2-chloro-5-(trifluoromethyl)phenyl]-11H-dibenzo[5,6:7,8][1,4]dioxocino[2,3-f]isoindole-11,13(12H)-dione
Chemical Structure Depiction of
12-[2-chloro-5-(trifluoromethyl)phenyl]-11H-dibenzo[5,6:7,8][1,4]dioxocino[2,3-f]isoindole-11,13(12H)-dione
12-[2-chloro-5-(trifluoromethyl)phenyl]-11H-dibenzo[5,6:7,8][1,4]dioxocino[2,3-f]isoindole-11,13(12H)-dione
Compound characteristics
| Compound ID: | 8017-0826 |
| Compound Name: | 12-[2-chloro-5-(trifluoromethyl)phenyl]-11H-dibenzo[5,6:7,8][1,4]dioxocino[2,3-f]isoindole-11,13(12H)-dione |
| Molecular Weight: | 507.85 |
| Molecular Formula: | C27 H13 Cl F3 N O4 |
| Smiles: | c1ccc2c(c1)c1ccccc1oc1cc3C(N(C(c3cc1o2)=O)c1cc(ccc1[Cl])C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7666 |
| logD: | 7.7666 |
| logSw: | -6.7953 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.378 |
| InChI Key: | BWFKYJSHYZRKDH-UHFFFAOYSA-N |