2-(3,4-dimethylphenoxy)-N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}acetamide
Chemical Structure Depiction of
2-(3,4-dimethylphenoxy)-N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}acetamide
2-(3,4-dimethylphenoxy)-N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}acetamide
Compound characteristics
| Compound ID: | F172-0807 |
| Compound Name: | 2-(3,4-dimethylphenoxy)-N-{5-(ethanesulfonyl)-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}acetamide |
| Molecular Weight: | 525.58 |
| Molecular Formula: | C26 H27 N3 O7 S |
| Smiles: | CCS(c1ccc(c(c1)NC(COc1ccc(C)c(C)c1)=O)OCC1=CC(N2C(C=C(C)O2)=N1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4821 |
| logD: | 2.48 |
| logSw: | -3.0059 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.732 |
| InChI Key: | LEQYWTKGQSBDET-UHFFFAOYSA-N |