2-[cyano(4-methoxyphenyl)methylidene]-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6,7-dicarbonitrile
Chemical Structure Depiction of
2-[cyano(4-methoxyphenyl)methylidene]-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6,7-dicarbonitrile
2-[cyano(4-methoxyphenyl)methylidene]-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6,7-dicarbonitrile
Compound characteristics
| Compound ID: | 8020-2229 |
| Compound Name: | 2-[cyano(4-methoxyphenyl)methylidene]-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6,7-dicarbonitrile |
| Molecular Weight: | 358.31 |
| Molecular Formula: | C19 H10 N4 O4 |
| Smiles: | COc1ccc(cc1)/C(C#N)=C1/C(N(c2cc(C#N)c(C#N)cc2O1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7488 |
| logD: | 0.1013 |
| logSw: | -2.4364 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.949 |
| InChI Key: | ZCCXHSBCXDXSGU-UHFFFAOYSA-N |