2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-(3-methylphenyl)thiophene-3-sulfonamide
Chemical Structure Depiction of
2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-(3-methylphenyl)thiophene-3-sulfonamide
2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-(3-methylphenyl)thiophene-3-sulfonamide
Compound characteristics
Compound ID: | F845-0651 |
Compound Name: | 2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-(3-methylphenyl)thiophene-3-sulfonamide |
Molecular Weight: | 455.51 |
Molecular Formula: | C21 H17 N3 O5 S2 |
Smiles: | Cc1cccc(c1)N(C)S(c1ccsc1c1nc(c2ccc3c(c2)OCO3)no1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.4972 |
logD: | 5.4972 |
logSw: | -5.5264 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 82.599 |
InChI Key: | SIWTVAHXTIGLHZ-UHFFFAOYSA-N |