(2-chloro-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-6-methoxyphenoxy)acetic acid
Chemical Structure Depiction of
(2-chloro-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-6-methoxyphenoxy)acetic acid
(2-chloro-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-6-methoxyphenoxy)acetic acid
Compound characteristics
| Compound ID: | 5553-0313 |
| Compound Name: | (2-chloro-4-{[1-(4-ethylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-6-methoxyphenoxy)acetic acid |
| Molecular Weight: | 458.85 |
| Molecular Formula: | C22 H19 Cl N2 O7 |
| Smiles: | CCc1ccc(cc1)N1C(C(=C\c2cc(c(c(c2)[Cl])OCC(O)=O)OC)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3926 |
| logD: | -0.8444 |
| logSw: | -3.816 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.077 |
| InChI Key: | BVKMFBLZEPCEHG-UHFFFAOYSA-N |