5-(2,5-dimethylanilino)-3-(4-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(2,5-dimethylanilino)-3-(4-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(2,5-dimethylanilino)-3-(4-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0656 |
| Compound Name: | 5-(2,5-dimethylanilino)-3-(4-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C28 H27 N3 O2 |
| Smiles: | CC1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 7.2824 |
| logD: | 7.2824 |
| logSw: | -5.9903 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.849 |
| InChI Key: | DBMDXCVNPSZIIK-UHFFFAOYSA-N |