[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl benzoate
Chemical Structure Depiction of
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl benzoate
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl benzoate
Compound characteristics
| Compound ID: | G265-0684 |
| Compound Name: | [5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl benzoate |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C17 H11 N3 O3 S2 |
| Smiles: | C(C1=CC(N2C(=N1)SC(c1cccs1)=N2)=O)OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4173 |
| logD: | 3.4173 |
| logSw: | -3.5759 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.147 |
| InChI Key: | OWQMTLGDKJVBAY-UHFFFAOYSA-N |