[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
Chemical Structure Depiction of
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
Compound characteristics
| Compound ID: | G265-0740 |
| Compound Name: | [5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C20 H17 N3 O3 S2 |
| Smiles: | CCC(C(=O)OCC1=CC(N2C(=N1)SC(c1cccs1)=N2)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1556 |
| logD: | 4.1556 |
| logSw: | -4.1542 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.147 |
| InChI Key: | MNGUYYCNDBQGPG-OAHLLOKOSA-N |