2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(3-methoxypropyl)acetamide
Chemical Structure Depiction of
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(3-methoxypropyl)acetamide
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(3-methoxypropyl)acetamide
Compound characteristics
| Compound ID: | C311-1591 |
| Compound Name: | 2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(3-methoxypropyl)acetamide |
| Molecular Weight: | 475.34 |
| Molecular Formula: | C22 H23 Br N2 O5 |
| Smiles: | COCCCNC(CN1C(/C(=C\c2ccc(c(c2)[Br])OC)Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8866 |
| logD: | 2.8866 |
| logSw: | -3.4602 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.59 |
| InChI Key: | CRDVKKHDRSAPTG-UHFFFAOYSA-N |