N-[1-(4-butoxyphenyl)ethyl]-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Chemical Structure Depiction of
N-[1-(4-butoxyphenyl)ethyl]-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
N-[1-(4-butoxyphenyl)ethyl]-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Compound characteristics
| Compound ID: | K788-5305 |
| Compound Name: | N-[1-(4-butoxyphenyl)ethyl]-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide |
| Molecular Weight: | 505.01 |
| Molecular Formula: | C29 H29 Cl N2 O4 |
| Smiles: | CCCCOc1ccc(cc1)C(C)NC(CN1C(/C(=C\c2cccc(c2)[Cl])Oc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1992 |
| logD: | 6.1992 |
| logSw: | -6.1694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.085 |
| InChI Key: | OQJVBXLYQAGQBA-FQEVSTJZSA-N |