3-[4-(4-fluorophenyl)piperazin-1-yl]-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-[4-(4-fluorophenyl)piperazin-1-yl]-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-[4-(4-fluorophenyl)piperazin-1-yl]-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0678 |
| Compound Name: | 3-[4-(4-fluorophenyl)piperazin-1-yl]-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 532.62 |
| Molecular Formula: | C33 H29 F N4 O2 |
| Smiles: | Cc1cc(C)c(c(C)c1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(CC1)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 7.9904 |
| logD: | 7.9904 |
| logSw: | -6.0408 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.412 |
| InChI Key: | VNVWTKKEFTZUDS-UHFFFAOYSA-N |