{4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-ethoxyphenoxy}acetic acid
Chemical Structure Depiction of
{4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-ethoxyphenoxy}acetic acid
{4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-ethoxyphenoxy}acetic acid
Compound characteristics
| Compound ID: | 5617-0860 |
| Compound Name: | {4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-ethoxyphenoxy}acetic acid |
| Molecular Weight: | 362.34 |
| Molecular Formula: | C17 H18 N2 O7 |
| Smiles: | CCOc1cc(C=C2C(N(C)C(N(C)C2=O)=O)=O)ccc1OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9009 |
| logD: | -3.336 |
| logSw: | -1.5675 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.305 |
| InChI Key: | XMJJSAGMVFAWLE-UHFFFAOYSA-N |