N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-fluorobenzamide
Chemical Structure Depiction of
N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-fluorobenzamide
N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-fluorobenzamide
Compound characteristics
| Compound ID: | C679-4876 |
| Compound Name: | N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-fluorobenzamide |
| Molecular Weight: | 436.46 |
| Molecular Formula: | C22 H17 F N4 O3 S |
| Smiles: | C1CC1C1=NN2C(=NC(COc3cccc(c3)NC(c3ccccc3F)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.7879 |
| logD: | 3.7778 |
| logSw: | -4.1837 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.113 |
| InChI Key: | PTFBUVFIRUBUCP-UHFFFAOYSA-N |