5-{[3-(dimethylamino)propyl]amino}-3-[4-(4-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-{[3-(dimethylamino)propyl]amino}-3-[4-(4-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-{[3-(dimethylamino)propyl]amino}-3-[4-(4-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0698 |
| Compound Name: | 5-{[3-(dimethylamino)propyl]amino}-3-[4-(4-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C29 H30 F N5 O2 |
| Smiles: | CN(C)CCCNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.3932 |
| logD: | 3.6059 |
| logSw: | -5.5203 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.108 |
| InChI Key: | JQCAEFCIWKMVEB-UHFFFAOYSA-N |