methyl (2-methoxy-4-{[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate
Chemical Structure Depiction of
methyl (2-methoxy-4-{[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate
methyl (2-methoxy-4-{[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate
Compound characteristics
| Compound ID: | 2897-1559 |
| Compound Name: | methyl (2-methoxy-4-{[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetate |
| Molecular Weight: | 440.47 |
| Molecular Formula: | C22 H20 N2 O6 S |
| Smiles: | Cc1ccc(cc1)N1C(C(=C\c2ccc(c(c2)OC)OCC(=O)OC)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2149 |
| logD: | 1.8399 |
| logSw: | -2.9871 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.023 |
| InChI Key: | WKQUWUXWNVLDHX-UHFFFAOYSA-N |