methyl (2-methoxy-4-{[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate
Chemical Structure Depiction of
methyl (2-methoxy-4-{[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate
methyl (2-methoxy-4-{[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate
Compound characteristics
| Compound ID: | 2897-1549 |
| Compound Name: | methyl (2-methoxy-4-{[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate |
| Molecular Weight: | 424.41 |
| Molecular Formula: | C22 H20 N2 O7 |
| Smiles: | Cc1ccc(cc1)N1C(C(=C\c2ccc(c(c2)OC)OCC(=O)OC)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7873 |
| logD: | 1.4843 |
| logSw: | -2.344 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.186 |
| InChI Key: | LRTOUMFQWFPFQC-UHFFFAOYSA-N |