[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (4-chlorophenoxy)acetate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (4-chlorophenoxy)acetate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (4-chlorophenoxy)acetate
Compound characteristics
| Compound ID: | G265-0093 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (4-chlorophenoxy)acetate |
| Molecular Weight: | 393.85 |
| Molecular Formula: | C17 H16 Cl N3 O4 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(COc3ccc(cc3)[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.259 |
| logD: | 3.2507 |
| logSw: | -3.5625 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.304 |
| InChI Key: | IMSAFAMQPLMNLO-UHFFFAOYSA-N |