5-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0157 |
| Compound Name: | 5-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C26 H24 N4 O3 |
| Smiles: | CN1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.588 |
| logD: | 5.2573 |
| logSw: | -5.7883 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.567 |
| InChI Key: | QSINWJATUNRXON-UHFFFAOYSA-N |