N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-3-phenylprop-2-enamide
N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | F172-0538 |
| Compound Name: | N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}-3-phenylprop-2-enamide |
| Molecular Weight: | 435.87 |
| Molecular Formula: | C23 H18 Cl N3 O4 |
| Smiles: | CC1=CC2=NC(COc3cc(ccc3NC(/C=C/c3ccccc3)=O)[Cl])=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1158 |
| logD: | 4.1116 |
| logSw: | -4.5534 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.196 |
| InChI Key: | PPWUHURXLKJJDB-UHFFFAOYSA-N |