ethyl 3-{7-[2-(3,5-dimethylanilino)-2-oxoethoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{7-[2-(3,5-dimethylanilino)-2-oxoethoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
ethyl 3-{7-[2-(3,5-dimethylanilino)-2-oxoethoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
Compound characteristics
| Compound ID: | Y041-2016 |
| Compound Name: | ethyl 3-{7-[2-(3,5-dimethylanilino)-2-oxoethoxy]-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl}propanoate |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C26 H29 N O6 |
| Smiles: | CCOC(CCC1=C(C)c2ccc(c(C)c2OC1=O)OCC(Nc1cc(C)cc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1003 |
| logD: | 5.1003 |
| logSw: | -4.9125 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.467 |
| InChI Key: | LTAWAYJBTOVGAL-UHFFFAOYSA-N |