methyl [4-({4,6-dioxo-1-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,3-diazinan-5-ylidene}methyl)-2-methoxyphenoxy]acetate
Chemical Structure Depiction of
methyl [4-({4,6-dioxo-1-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,3-diazinan-5-ylidene}methyl)-2-methoxyphenoxy]acetate
methyl [4-({4,6-dioxo-1-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,3-diazinan-5-ylidene}methyl)-2-methoxyphenoxy]acetate
Compound characteristics
| Compound ID: | 2897-1561 |
| Compound Name: | methyl [4-({4,6-dioxo-1-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,3-diazinan-5-ylidene}methyl)-2-methoxyphenoxy]acetate |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C24 H24 N2 O6 S |
| Smiles: | CC(C)c1ccc(cc1)N1C(C(=C\c2ccc(c(c2)OC)OCC(=O)OC)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1297 |
| logD: | 2.7547 |
| logSw: | -3.4425 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.023 |
| InChI Key: | MJXJPTQKXGAFRX-UHFFFAOYSA-N |