3-(4-tert-butylphenoxy)-5-(2,4-dimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(4-tert-butylphenoxy)-5-(2,4-dimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(4-tert-butylphenoxy)-5-(2,4-dimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | 0310-0457 |
| Compound Name: | 3-(4-tert-butylphenoxy)-5-(2,4-dimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 488.59 |
| Molecular Formula: | C32 H28 N2 O3 |
| Smiles: | Cc1ccc(c(C)c1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)Oc1ccc(cc1)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 9.5055 |
| logD: | 9.5055 |
| logSw: | -6.0251 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.532 |
| InChI Key: | WIGYNLLREKDNNH-UHFFFAOYSA-N |