5-(4-methylanilino)-3-(pentafluorophenoxy)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(4-methylanilino)-3-(pentafluorophenoxy)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(4-methylanilino)-3-(pentafluorophenoxy)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | 0310-0081 |
| Compound Name: | 5-(4-methylanilino)-3-(pentafluorophenoxy)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 508.4 |
| Molecular Formula: | C27 H13 F5 N2 O3 |
| Smiles: | Cc1ccc(cc1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)Oc1c(c(c(c(c1F)F)F)F)F |
| Stereo: | ACHIRAL |
| logP: | 8.162 |
| logD: | 8.162 |
| logSw: | -6.1088 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.403 |
| InChI Key: | YECKDLOBFULGFS-UHFFFAOYSA-N |