N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-3-methoxybenzamide
Chemical Structure Depiction of
N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-3-methoxybenzamide
N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-3-methoxybenzamide
Compound characteristics
| Compound ID: | C679-4391 |
| Compound Name: | N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-3-methoxybenzamide |
| Molecular Weight: | 436.49 |
| Molecular Formula: | C22 H20 N4 O4 S |
| Smiles: | CCC1=NN2C(=NC(COc3cccc(c3)NC(c3cccc(c3)OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.6179 |
| logD: | 3.6113 |
| logSw: | -3.9064 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.308 |
| InChI Key: | BZQIDKNPZFYZOY-UHFFFAOYSA-N |