N-{5-methyl-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}adamantane-1-carboxamide
Chemical Structure Depiction of
N-{5-methyl-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}adamantane-1-carboxamide
N-{5-methyl-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}adamantane-1-carboxamide
Compound characteristics
| Compound ID: | G808-0851 |
| Compound Name: | N-{5-methyl-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}adamantane-1-carboxamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C26 H29 N3 O4 |
| Smiles: | [H][C@@]12CC3(C[C@@]([H])(C1)C[C@]([H])(C3)C2)C(Nc1cc(C)ccc1OCC1=CC(N2C(C=C(C)O2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.286 |
| logD: | 4.2855 |
| logSw: | -4.4234 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.443 |
| InChI Key: | DRUPHYVMZRPXQT-UHFFFAOYSA-N |