5-{[2-(dimethylamino)ethyl]amino}-3-[4-(furan-2-carbonyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-{[2-(dimethylamino)ethyl]amino}-3-[4-(furan-2-carbonyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-{[2-(dimethylamino)ethyl]amino}-3-[4-(furan-2-carbonyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0049 |
| Compound Name: | 5-{[2-(dimethylamino)ethyl]amino}-3-[4-(furan-2-carbonyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 485.54 |
| Molecular Formula: | C27 H27 N5 O4 |
| Smiles: | CN(C)CCNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8092 |
| logD: | 2.3707 |
| logSw: | -4.3259 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.882 |
| InChI Key: | YIPSHIMYSDBWNX-UHFFFAOYSA-N |