N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-methoxybenzamide
N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | C679-5837 |
| Compound Name: | N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-methoxybenzamide |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C26 H26 N4 O4 S |
| Smiles: | COc1ccccc1C(Nc1cccc(c1)OCC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8262 |
| logD: | 4.8193 |
| logSw: | -4.6274 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.412 |
| InChI Key: | HSRFLZASPBPYSQ-UHFFFAOYSA-N |