N-[1-(4-butoxyphenyl)ethyl]-2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Chemical Structure Depiction of
N-[1-(4-butoxyphenyl)ethyl]-2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
N-[1-(4-butoxyphenyl)ethyl]-2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide
Compound characteristics
| Compound ID: | K788-2007 |
| Compound Name: | N-[1-(4-butoxyphenyl)ethyl]-2-{6-tert-butyl-2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetamide |
| Molecular Weight: | 561.12 |
| Molecular Formula: | C33 H37 Cl N2 O4 |
| Smiles: | CCCCOc1ccc(cc1)C(C)NC(CN1C(/C(=C\c2ccc(cc2)[Cl])Oc2ccc(cc12)C(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.8893 |
| logD: | 7.8893 |
| logSw: | -6.4852 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.085 |
| InChI Key: | QDTDPUGUIVAAEN-QFIPXVFZSA-N |