N-butyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-butyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
N-butyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | K788-4797 |
| Compound Name: | N-butyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C20 H20 N2 O3 |
| Smiles: | CCCCNC(c1ccc(/C=C2/C(Nc3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7003 |
| logD: | 3.7003 |
| logSw: | -4.0111 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.334 |
| InChI Key: | KSUTYUBDGAXQET-UHFFFAOYSA-N |