5-(2,5-dimethylanilino)-3-(4-ethylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(2,5-dimethylanilino)-3-(4-ethylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(2,5-dimethylanilino)-3-(4-ethylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0631 |
| Compound Name: | 5-(2,5-dimethylanilino)-3-(4-ethylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 452.56 |
| Molecular Formula: | C28 H28 N4 O2 |
| Smiles: | CCN1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 6.1148 |
| logD: | 5.6954 |
| logSw: | -5.8286 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.386 |
| InChI Key: | QVJATAZOQCLGIP-UHFFFAOYSA-N |