ethyl [(2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate
ethyl [(2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 3202-0395 |
| Compound Name: | ethyl [(2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C18 H20 N2 O6 S2 |
| Smiles: | CCOC(CSCCOc1ccc(C=C2C(NC(NC2=O)=S)=O)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3064 |
| logD: | 1.8809 |
| logSw: | -2.9081 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.919 |
| InChI Key: | FKPGGECTFJGYCD-UHFFFAOYSA-N |