3-bromo-N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamide
Chemical Structure Depiction of
3-bromo-N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamide
3-bromo-N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamide
Compound characteristics
| Compound ID: | F172-0450 |
| Compound Name: | 3-bromo-N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamide |
| Molecular Weight: | 488.72 |
| Molecular Formula: | C21 H15 Br Cl N3 O4 |
| Smiles: | CC1=CC2=NC(COc3cc(ccc3NC(c3cccc(c3)[Br])=O)[Cl])=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1828 |
| logD: | 3.6793 |
| logSw: | -4.5988 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.41 |
| InChI Key: | DBGHGTNGOUXQQK-UHFFFAOYSA-N |