2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclopentylacetamide
Chemical Structure Depiction of
2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclopentylacetamide
2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclopentylacetamide
Compound characteristics
| Compound ID: | K788-1172 |
| Compound Name: | 2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-cyclopentylacetamide |
| Molecular Weight: | 452.98 |
| Molecular Formula: | C26 H29 Cl N2 O3 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(NC1CCCC1)=O)C(/C(=C\c1ccc(cc1)[Cl])O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9931 |
| logD: | 5.9931 |
| logSw: | -6.2729 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.596 |
| InChI Key: | PGDWTKLYDXVQSE-UHFFFAOYSA-N |