(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl acetate
Chemical Structure Depiction of
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl acetate
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl acetate
Compound characteristics
| Compound ID: | G265-0249 |
| Compound Name: | (2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl acetate |
| Molecular Weight: | 281.33 |
| Molecular Formula: | C12 H15 N3 O3 S |
| Smiles: | CCCCC1=NN2C(=NC(COC(C)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.073 |
| logD: | 2.0721 |
| logSw: | -2.0318 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.677 |
| InChI Key: | NUVFPPMRUYZTEA-UHFFFAOYSA-N |