N-(2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}ethyl)-3,4-dimethylbenzamide
Chemical Structure Depiction of
N-(2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}ethyl)-3,4-dimethylbenzamide
N-(2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}ethyl)-3,4-dimethylbenzamide
Compound characteristics
| Compound ID: | S334-0195 |
| Compound Name: | N-(2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}ethyl)-3,4-dimethylbenzamide |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C24 H22 N4 O4 |
| Smiles: | Cc1ccc(cc1C)C(NCCn1cccc1c1nc(c2ccc3c(c2)OCO3)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0852 |
| logD: | 5.0852 |
| logSw: | -4.8641 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.854 |
| InChI Key: | YVKVHCFLTQDFMB-UHFFFAOYSA-N |