5-{[3-(dimethylamino)propyl]amino}-3-(4-phenylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-{[3-(dimethylamino)propyl]amino}-3-(4-phenylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-{[3-(dimethylamino)propyl]amino}-3-(4-phenylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0712 |
| Compound Name: | 5-{[3-(dimethylamino)propyl]amino}-3-(4-phenylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 481.6 |
| Molecular Formula: | C29 H31 N5 O2 |
| Smiles: | CN(C)CCCNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2426 |
| logD: | 3.4552 |
| logSw: | -5.2304 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.108 |
| InChI Key: | HUGJBFBFTYNLEL-UHFFFAOYSA-N |