[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3,4-dimethylphenoxy)acetate
Chemical Structure Depiction of
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3,4-dimethylphenoxy)acetate
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3,4-dimethylphenoxy)acetate
Compound characteristics
| Compound ID: | G265-0708 |
| Compound Name: | [5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (3,4-dimethylphenoxy)acetate |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C20 H17 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1C)OCC(=O)OCC1=CC(N2C(=N1)SC(c1cccs1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8682 |
| logD: | 3.8682 |
| logSw: | -3.9658 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.051 |
| InChI Key: | BMMKWWVJMNBTCP-UHFFFAOYSA-N |