N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-4-methylbenzamide
N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | C679-4862 |
| Compound Name: | N-{3-[(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-4-methylbenzamide |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C23 H20 N4 O3 S |
| Smiles: | Cc1ccc(cc1)C(Nc1cccc(c1)OCC1=CC(N2C(=N1)SC(C1CC1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2283 |
| logD: | 4.2209 |
| logSw: | -4.3571 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.113 |
| InChI Key: | LWSWLPZVUCZNFV-UHFFFAOYSA-N |