N-(3-chloro-4-methoxyphenyl)-3-[1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-3-[1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-amine
N-(3-chloro-4-methoxyphenyl)-3-[1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-amine
Compound characteristics
Compound ID: | M213-0549 |
Compound Name: | N-(3-chloro-4-methoxyphenyl)-3-[1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-amine |
Molecular Weight: | 442.93 |
Molecular Formula: | C20 H19 Cl N6 O2 S |
Smiles: | CCOc1ccc(cc1)n1c(C)c(c2nc(Nc3ccc(c(c3)[Cl])OC)sn2)nn1 |
Stereo: | ACHIRAL |
logP: | 5.0586 |
logD: | 5.0586 |
logSw: | -5.3314 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.336 |
InChI Key: | ZZOFWSQYHSSZRR-UHFFFAOYSA-N |