N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-ethylbutanamide
Chemical Structure Depiction of
N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-ethylbutanamide
N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-ethylbutanamide
Compound characteristics
| Compound ID: | F172-0790 |
| Compound Name: | N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-2-ethylbutanamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C22 H27 N3 O6 S |
| Smiles: | CCC(CC)C(Nc1cc(ccc1OCC1=CC(N2C(C=C(C)O2)=N1)=O)S(CC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6984 |
| logD: | 1.6906 |
| logSw: | -2.6695 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.717 |
| InChI Key: | GXHVOCPDFBFBNC-UHFFFAOYSA-N |