ethyl (4-{[1-(3,5-dimethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate
Chemical Structure Depiction of
ethyl (4-{[1-(3,5-dimethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate
ethyl (4-{[1-(3,5-dimethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate
Compound characteristics
| Compound ID: | 4490-1026 |
| Compound Name: | ethyl (4-{[1-(3,5-dimethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate |
| Molecular Weight: | 452.46 |
| Molecular Formula: | C24 H24 N2 O7 |
| Smiles: | CCOC(COc1ccc(\C=C2/C(NC(N(C2=O)c2cc(C)cc(C)c2)=O)=O)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.865 |
| logD: | 2.8493 |
| logSw: | -3.2474 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.766 |
| InChI Key: | KRVKFWYOIGSCKZ-UHFFFAOYSA-N |