N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L957-0074 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide |
| Molecular Weight: | 456.48 |
| Molecular Formula: | C21 H20 N4 O6 S |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)c1nnc(C(NCc2ccc3c(c2)OCO3)=O)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1478 |
| logD: | 2.1478 |
| logSw: | -2.8711 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.36 |
| InChI Key: | BYTUIBPKTNPTEY-UHFFFAOYSA-N |