[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate
Compound characteristics
| Compound ID: | G265-0108 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2H-1,3-benzodioxole-5-carboxylate |
| Molecular Weight: | 373.39 |
| Molecular Formula: | C17 H15 N3 O5 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccc4c(c3)OCO4)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.157 |
| logD: | 3.1487 |
| logSw: | -3.3139 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.515 |
| InChI Key: | MJTLUVNOPRZYNZ-UHFFFAOYSA-N |