N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-phenylbutanamide
Chemical Structure Depiction of
N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-phenylbutanamide
N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-phenylbutanamide
Compound characteristics
| Compound ID: | C679-4405 |
| Compound Name: | N-{3-[(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}-2-phenylbutanamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | CCC(C(Nc1cccc(c1)OCC1=CC(N2C(=N1)SC(CC)=N2)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4228 |
| logD: | 4.4162 |
| logSw: | -4.3377 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.765 |
| InChI Key: | BXXOEVJNTLIRGP-HXUWFJFHSA-N |