5-(4-ethoxyanilino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(4-ethoxyanilino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(4-ethoxyanilino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
Compound ID: | C090-0341 |
Compound Name: | 5-(4-ethoxyanilino)-3-(piperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
Molecular Weight: | 439.51 |
Molecular Formula: | C27 H25 N3 O3 |
Smiles: | CCOc1ccc(cc1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCCCC1 |
Stereo: | ACHIRAL |
logP: | 7.0725 |
logD: | 7.0725 |
logSw: | -5.9555 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.671 |
InChI Key: | RYWAGRNIUIDRKO-UHFFFAOYSA-N |