2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[1-(4-butoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[1-(4-butoxyphenyl)ethyl]acetamide
2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[1-(4-butoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-6295 |
| Compound Name: | 2-{2-[(2-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[1-(4-butoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 549.46 |
| Molecular Formula: | C29 H29 Br N2 O4 |
| Smiles: | CCCCOc1ccc(cc1)C(C)NC(CN1C(/C(=C\c2ccccc2[Br])Oc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2218 |
| logD: | 6.2218 |
| logSw: | -5.5151 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.085 |
| InChI Key: | DBFAEOIZWUCZCK-FQEVSTJZSA-N |