(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methylbenzoate
Chemical Structure Depiction of
(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methylbenzoate
(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methylbenzoate
Compound characteristics
| Compound ID: | G265-0329 |
| Compound Name: | (2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methylbenzoate |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | Cc1ccccc1C(=O)OCC1=CC(N2C(=N1)SC(C1CC1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.256 |
| logD: | 3.249 |
| logSw: | -3.5559 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.652 |
| InChI Key: | VHBKJGVWQGAGIG-UHFFFAOYSA-N |