2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide
Chemical Structure Depiction of
2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide
2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide
Compound characteristics
| Compound ID: | K786-4161 |
| Compound Name: | 2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[ethyl(3-methylphenyl)amino]propyl}acetamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C25 H32 N2 O4 |
| Smiles: | CCN(CCCNC(COc1ccc2c(c1)C(CC(C)(C)O2)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.7403 |
| logD: | 3.708 |
| logSw: | -3.959 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.35 |
| InChI Key: | KKPMERVLLHYGNO-UHFFFAOYSA-N |