3-methyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide
Chemical Structure Depiction of
3-methyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide
3-methyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide
Compound characteristics
| Compound ID: | C679-6511 |
| Compound Name: | 3-methyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C20 H24 N4 O3 S |
| Smiles: | CCCC1=NN2C(=NC(COc3cccc(c3)NC(CC(C)C)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.8907 |
| logD: | 3.8867 |
| logSw: | -4.0488 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.823 |
| InChI Key: | RBRBHQYVCFVPLI-UHFFFAOYSA-N |