ethyl (4-{[1-(4-chlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate
Chemical Structure Depiction of
ethyl (4-{[1-(4-chlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate
ethyl (4-{[1-(4-chlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate
Compound characteristics
| Compound ID: | 4299-0361 |
| Compound Name: | ethyl (4-{[1-(4-chlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}-2-methoxyphenoxy)acetate |
| Molecular Weight: | 474.92 |
| Molecular Formula: | C22 H19 Cl N2 O6 S |
| Smiles: | CCOC(COc1ccc(/C=C2/C(NC(N(C2=O)c2ccc(cc2)[Cl])=S)=O)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8521 |
| logD: | 2.477 |
| logSw: | -3.7088 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.603 |
| InChI Key: | JGQRJTSOVVHPFX-UHFFFAOYSA-N |