N-[2-(4-chlorophenyl)-5-oxo-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)-5-oxo-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide
N-[2-(4-chlorophenyl)-5-oxo-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | J062-0641 |
| Compound Name: | N-[2-(4-chlorophenyl)-5-oxo-5H-[1,3,4]oxadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide |
| Molecular Weight: | 426.81 |
| Molecular Formula: | C20 H15 Cl N4 O5 |
| Smiles: | COc1ccc(cc1OC)C(NC1=CN=C2N(C1=O)N=C(c1ccc(cc1)[Cl])O2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8223 |
| logD: | 1.1555 |
| logSw: | -2.9155 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.3 |
| InChI Key: | JHQQPBAKNDIANK-UHFFFAOYSA-N |