3-(4-ethylpiperazin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(4-ethylpiperazin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(4-ethylpiperazin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
Compound ID: | C620-0689 |
Compound Name: | 3-(4-ethylpiperazin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
Molecular Weight: | 466.58 |
Molecular Formula: | C29 H30 N4 O2 |
Smiles: | CCN1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1c(C)cc(C)cc1C |
Stereo: | ACHIRAL |
logP: | 6.3674 |
logD: | 5.9479 |
logSw: | -5.8684 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.688 |
InChI Key: | ZAALSBVTZDNIAP-UHFFFAOYSA-N |