4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide
Chemical Structure Depiction of
4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide
4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | K788-6790 |
| Compound Name: | 4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide |
| Molecular Weight: | 597.11 |
| Molecular Formula: | C35 H33 Cl N2 O5 |
| Smiles: | CCOc1ccc(CCNC(c2ccc(/C=C3/C(N(Cc4ccc(cc4)[Cl])c4ccccc4O3)=O)cc2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 6.0481 |
| logD: | 6.0481 |
| logSw: | -6.1818 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.708 |
| InChI Key: | KQDYFRCKZHUKAC-UHFFFAOYSA-N |