5-(2,5-dimethylanilino)-3-[4-(2-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(2,5-dimethylanilino)-3-[4-(2-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(2,5-dimethylanilino)-3-[4-(2-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0641 |
| Compound Name: | 5-(2,5-dimethylanilino)-3-[4-(2-fluorophenyl)piperazin-1-yl]-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 518.59 |
| Molecular Formula: | C32 H27 F N4 O2 |
| Smiles: | Cc1ccc(C)c(c1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 7.7658 |
| logD: | 7.7658 |
| logSw: | -6.0446 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.808 |
| InChI Key: | YJAGEHFDDTWHRX-UHFFFAOYSA-N |