(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylbutanoate
Chemical Structure Depiction of
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylbutanoate
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylbutanoate
Compound characteristics
| Compound ID: | G265-0018 |
| Compound Name: | (2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-ethylbutanoate |
| Molecular Weight: | 295.36 |
| Molecular Formula: | C13 H17 N3 O3 S |
| Smiles: | CCC(CC)C(=O)OCC1=CC(N2C(=N1)SC(C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5321 |
| logD: | 2.527 |
| logSw: | -2.3184 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.845 |
| InChI Key: | PGHCFJCHUVRIMK-UHFFFAOYSA-N |