[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate
Chemical Structure Depiction of
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate
Compound characteristics
| Compound ID: | G265-0706 |
| Compound Name: | [5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3-methylphenoxy)acetate |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C19 H15 N3 O4 S2 |
| Smiles: | Cc1cccc(c1)OCC(=O)OCC1=CC(N2C(=N1)SC(c1cccs1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3231 |
| logD: | 3.323 |
| logSw: | -3.4748 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.051 |
| InChI Key: | RJCDGHWOWTVLFX-UHFFFAOYSA-N |