N-{2-[2-(4-chlorophenyl)-6-methyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-{2-[2-(4-chlorophenyl)-6-methyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-{2-[2-(4-chlorophenyl)-6-methyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
Compound ID: | G856-8414 |
Compound Name: | N-{2-[2-(4-chlorophenyl)-6-methyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
Molecular Weight: | 490.99 |
Molecular Formula: | C21 H19 Cl N4 O4 S2 |
Smiles: | Cc1c(CCNS(c2ccc3c(c2)OCCO3)(=O)=O)sc2nc(c3ccc(cc3)[Cl])nn12 |
Stereo: | ACHIRAL |
logP: | 3.7659 |
logD: | 3.7659 |
logSw: | -4.4645 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.131 |
InChI Key: | COBQUNXERRZRPS-UHFFFAOYSA-N |