{3-[(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetic acid
Chemical Structure Depiction of
{3-[(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetic acid
{3-[(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetic acid
Compound characteristics
| Compound ID: | 2896-4043 |
| Compound Name: | {3-[(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetic acid |
| Molecular Weight: | 304.26 |
| Molecular Formula: | C14 H12 N2 O6 |
| Smiles: | CN1C(C(=C/c2cccc(c2)OCC(O)=O)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6115 |
| logD: | -3.6255 |
| logSw: | -1.951 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.922 |
| InChI Key: | RGCRUNJXMOLRQP-UHFFFAOYSA-N |