[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
Compound characteristics
| Compound ID: | G265-0120 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate |
| Molecular Weight: | 371.46 |
| Molecular Formula: | C19 H21 N3 O3 S |
| Smiles: | CCC(C(=O)OCC1=CC(N2C(=N1)SC(C(C)C)=N2)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9881 |
| logD: | 3.9798 |
| logSw: | -4.0819 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.4 |
| InChI Key: | VCNGBBUTBIKZFQ-OAHLLOKOSA-N |