(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (2-methylphenoxy)acetate
Chemical Structure Depiction of
(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (2-methylphenoxy)acetate
(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (2-methylphenoxy)acetate
Compound characteristics
| Compound ID: | G265-0581 |
| Compound Name: | (2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (2-methylphenoxy)acetate |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | Cc1ccccc1OCC(=O)OCC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1302 |
| logD: | 4.13 |
| logSw: | -4.41 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.311 |
| InChI Key: | STJDLWUHJKTVTJ-UHFFFAOYSA-N |