N-{3-[1-(2-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{3-[1-(2-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide
N-{3-[1-(2-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide
Compound characteristics
Compound ID: | G193-0619 |
Compound Name: | N-{3-[1-(2-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-2-methoxybenzamide |
Molecular Weight: | 436.49 |
Molecular Formula: | C21 H20 N6 O3 S |
Smiles: | CCOc1ccccc1n1c(C)c(c2nc(NC(c3ccccc3OC)=O)sn2)nn1 |
Stereo: | ACHIRAL |
logP: | 3.622 |
logD: | 3.5486 |
logSw: | -3.9522 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.3 |
InChI Key: | PNDKVTIQYGELSB-UHFFFAOYSA-N |