5-(2,5-dimethylanilino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(2,5-dimethylanilino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(2,5-dimethylanilino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0638 |
| Compound Name: | 5-(2,5-dimethylanilino)-3-[4-(pyridin-2-yl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 501.59 |
| Molecular Formula: | C31 H27 N5 O2 |
| Smiles: | Cc1ccc(C)c(c1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 7.2549 |
| logD: | 7.2493 |
| logSw: | -5.9275 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.621 |
| InChI Key: | VQCBTPCWEWDCQV-UHFFFAOYSA-N |