(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (3,4-dimethylphenoxy)acetate
Chemical Structure Depiction of
(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (3,4-dimethylphenoxy)acetate
(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (3,4-dimethylphenoxy)acetate
Compound characteristics
| Compound ID: | G265-0584 |
| Compound Name: | (2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (3,4-dimethylphenoxy)acetate |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | Cc1ccc(cc1C)OCC(=O)OCC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6918 |
| logD: | 4.6917 |
| logSw: | -4.4851 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.225 |
| InChI Key: | RZTQULUQWOTGLJ-UHFFFAOYSA-N |