2-ethoxy-6-iodo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 4-methoxybenzoate
Chemical Structure Depiction of
2-ethoxy-6-iodo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 4-methoxybenzoate
2-ethoxy-6-iodo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 3681-1216 |
| Compound Name: | 2-ethoxy-6-iodo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 4-methoxybenzoate |
| Molecular Weight: | 536.28 |
| Molecular Formula: | C21 H17 I N2 O7 |
| Smiles: | CCOc1cc(C=C2C(NC(NC2=O)=O)=O)cc(c1OC(c1ccc(cc1)OC)=O)I |
| Stereo: | ACHIRAL |
| logP: | 3.1141 |
| logD: | 2.7669 |
| logSw: | -3.5154 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.948 |
| InChI Key: | KAKNNLWIVRDYOI-UHFFFAOYSA-N |