[2-(2-methoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate
Chemical Structure Depiction of
[2-(2-methoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate
[2-(2-methoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate
Compound characteristics
| Compound ID: | G265-0976 |
| Compound Name: | [2-(2-methoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate |
| Molecular Weight: | 389.38 |
| Molecular Formula: | C17 H15 N3 O6 S |
| Smiles: | COCCC1=NN2C(=NC(COC(c3ccc4c(c3)OCO4)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.1178 |
| logD: | 2.1162 |
| logSw: | -2.7608 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.761 |
| InChI Key: | RCIGDBKMSJSEBY-UHFFFAOYSA-N |