N-{5-oxo-2-[4-(propan-2-yl)phenyl]-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl}benzamide
Chemical Structure Depiction of
N-{5-oxo-2-[4-(propan-2-yl)phenyl]-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl}benzamide
N-{5-oxo-2-[4-(propan-2-yl)phenyl]-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl}benzamide
Compound characteristics
| Compound ID: | J062-0466 |
| Compound Name: | N-{5-oxo-2-[4-(propan-2-yl)phenyl]-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl}benzamide |
| Molecular Weight: | 374.4 |
| Molecular Formula: | C21 H18 N4 O3 |
| Smiles: | CC(C)c1ccc(cc1)C1=NN2C(=NC=C(C2=O)NC(c2ccccc2)=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 2.8365 |
| logD: | 1.3488 |
| logSw: | -3.5513 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.04 |
| InChI Key: | YSBIZBGSHPNLFM-UHFFFAOYSA-N |