N'-[(3-chlorophenyl)methylidene]-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Chemical Structure Depiction of
N'-[(3-chlorophenyl)methylidene]-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
N'-[(3-chlorophenyl)methylidene]-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Compound characteristics
Compound ID: | Y508-1484 |
Compound Name: | N'-[(3-chlorophenyl)methylidene]-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide |
Molecular Weight: | 527.05 |
Molecular Formula: | C28 H23 Cl N6 O S |
Smiles: | C(c1nnc(n1c1ccccc1)SCC(N/N=C/c1cccc(c1)[Cl])=O)Nc1cccc2ccccc12 |
Stereo: | ACHIRAL |
logP: | 5.5382 |
logD: | 5.5366 |
logSw: | -6.4101 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.599 |
InChI Key: | BRUKHGNEKKHWEA-UHFFFAOYSA-N |