N-{3-[1-(2-chlorophenyl)-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-(2-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
N-{3-[1-(2-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
Compound characteristics
Compound ID: | G193-0341 |
Compound Name: | N-{3-[1-(2-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide |
Molecular Weight: | 402.88 |
Molecular Formula: | C16 H11 Cl N6 O S2 |
Smiles: | Cc1c(c2nc(NC(c3cccs3)=O)sn2)nnn1c1ccccc1[Cl] |
Stereo: | ACHIRAL |
logP: | 3.8603 |
logD: | 3.8598 |
logSw: | -4.1852 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.478 |
InChI Key: | UYVXNWPTDFBQOM-UHFFFAOYSA-N |