2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,2-dimethoxyethyl)acetamide
Chemical Structure Depiction of
2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,2-dimethoxyethyl)acetamide
2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,2-dimethoxyethyl)acetamide
Compound characteristics
| Compound ID: | K788-2006 |
| Compound Name: | 2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-(2,2-dimethoxyethyl)acetamide |
| Molecular Weight: | 472.97 |
| Molecular Formula: | C25 H29 Cl N2 O5 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(NCC(OC)OC)=O)C(/C(=C\c1ccc(cc1)[Cl])O2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1808 |
| logD: | 4.1808 |
| logSw: | -4.9081 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.27 |
| InChI Key: | DJIKCGNWXPSBIK-UHFFFAOYSA-N |