N-(2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}ethyl)-6-methylpyridine-3-carboxamide
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)-6-methylpyridine-3-carboxamide
N-(2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}ethyl)-6-methylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | S334-0265 |
| Compound Name: | N-(2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}ethyl)-6-methylpyridine-3-carboxamide |
| Molecular Weight: | 417.42 |
| Molecular Formula: | C22 H19 N5 O4 |
| Smiles: | Cc1ccc(cn1)C(NCCn1cccc1c1nc(c2ccc3c(c2)OCO3)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5478 |
| logD: | 3.5476 |
| logSw: | -3.3729 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.798 |
| InChI Key: | MQLOAVFMKDMRFM-UHFFFAOYSA-N |