4-{[(7-methoxyquinolin-3-yl)amino]methylidene}-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{[(7-methoxyquinolin-3-yl)amino]methylidene}-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
4-{[(7-methoxyquinolin-3-yl)amino]methylidene}-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0127 |
| Compound Name: | 4-{[(7-methoxyquinolin-3-yl)amino]methylidene}-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 390.35 |
| Molecular Formula: | C20 H14 N4 O5 |
| Smiles: | COc1ccc2cc(cnc2c1)N/C=C1/C(=O)OC(c2ccc(cc2)[N+]([O-])=O)=N1 |
| Stereo: | ACHIRAL |
| logP: | 3.2681 |
| logD: | 3.2681 |
| logSw: | -3.5918 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.754 |
| InChI Key: | NZBMKYUIUNDMFQ-UHFFFAOYSA-N |