N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}propanamide
Compound characteristics
| Compound ID: | L826-1232 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}propanamide |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C21 H22 N4 O4 |
| Smiles: | CN(C)c1ccc(cc1)c1nc(CCC(NCc2ccc3c(c2)OCO3)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.4067 |
| logD: | 3.4067 |
| logSw: | -3.7892 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.701 |
| InChI Key: | QXHMSPIOHNGFDQ-UHFFFAOYSA-N |