N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | K788-4406 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C26 H24 N2 O5 |
| Smiles: | COc1ccc(CCNC(c2ccc(/C=C3/C(Nc4ccccc4O3)=O)cc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.3384 |
| logD: | 3.3384 |
| logSw: | -3.7419 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.323 |
| InChI Key: | IXWJSVBMOLZLBK-UHFFFAOYSA-N |