N-[2-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Chemical Structure Depiction of
N-[2-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
N-[2-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Compound characteristics
Compound ID: | 8018-8152 |
Compound Name: | N-[2-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide |
Molecular Weight: | 393.42 |
Molecular Formula: | C19 H15 N5 O3 S |
Smiles: | Cc1nnc2n1nc(c1ccccc1NC(c1ccc3c(c1)OCCO3)=O)s2 |
Stereo: | ACHIRAL |
logP: | 1.5538 |
logD: | 1.5538 |
logSw: | -2.7372 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.987 |
InChI Key: | XXGIQOHUEOKWRI-UHFFFAOYSA-N |