[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate
Compound characteristics
| Compound ID: | G265-0086 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C18 H19 N3 O4 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(COc3cccc(C)c3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.1555 |
| logD: | 3.1472 |
| logSw: | -3.1197 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.304 |
| InChI Key: | GUBOLCWWTSIVBW-UHFFFAOYSA-N |