(5-bromo-2-ethoxy-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(5-bromo-2-ethoxy-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
(5-bromo-2-ethoxy-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 4299-0835 |
| Compound Name: | (5-bromo-2-ethoxy-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 517.33 |
| Molecular Formula: | C23 H21 Br N2 O7 |
| Smiles: | CCc1ccc(cc1)N1C(C(=C/c2cc(c(cc2[Br])OCC(O)=O)OCC)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6306 |
| logD: | -1.6064 |
| logSw: | -2.8673 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.571 |
| InChI Key: | NGIGDVWUVQLXFH-UHFFFAOYSA-N |