ethyl {4-bromo-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetate
Chemical Structure Depiction of
ethyl {4-bromo-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetate
ethyl {4-bromo-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetate
Compound characteristics
| Compound ID: | 3174-0272 |
| Compound Name: | ethyl {4-bromo-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetate |
| Molecular Weight: | 397.18 |
| Molecular Formula: | C15 H13 Br N2 O6 |
| Smiles: | CCOC(COc1ccc(cc1C=C1C(NC(NC1=O)=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.5844 |
| logD: | 1.3781 |
| logSw: | -2.3245 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.388 |
| InChI Key: | PSHGBBNQTSDPFY-UHFFFAOYSA-N |