N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]thiophene-3-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]thiophene-3-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]thiophene-3-sulfonamide
Compound characteristics
| Compound ID: | L824-0075 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,2,4-oxadiazol-3-yl]thiophene-3-sulfonamide |
| Molecular Weight: | 476.53 |
| Molecular Formula: | C20 H20 N4 O6 S2 |
| Smiles: | Cc1c(cc(c2nc(C(N3CCCC3)=O)on2)s1)S(NCc1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2589 |
| logD: | 3.2582 |
| logSw: | -3.4678 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.822 |
| InChI Key: | IUJNMSZWEULIDR-UHFFFAOYSA-N |