N-{3-[1-(3-chloro-4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[1-(3-chloro-4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
N-{3-[1-(3-chloro-4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
Compound characteristics
Compound ID: | G193-0357 |
Compound Name: | N-{3-[1-(3-chloro-4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide |
Molecular Weight: | 432.91 |
Molecular Formula: | C17 H13 Cl N6 O2 S2 |
Smiles: | Cc1c(c2nc(NC(c3cccs3)=O)sn2)nnn1c1ccc(c(c1)[Cl])OC |
Stereo: | ACHIRAL |
logP: | 3.8141 |
logD: | 3.8135 |
logSw: | -4.3512 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.409 |
InChI Key: | OWOFPQRZERBXTL-UHFFFAOYSA-N |