N'-[(3-bromophenyl)methylidene]-2-({5-[(4-chloroanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Chemical Structure Depiction of
N'-[(3-bromophenyl)methylidene]-2-({5-[(4-chloroanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
N'-[(3-bromophenyl)methylidene]-2-({5-[(4-chloroanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Compound characteristics
Compound ID: | Y500-6067 |
Compound Name: | N'-[(3-bromophenyl)methylidene]-2-({5-[(4-chloroanilino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide |
Molecular Weight: | 519.85 |
Molecular Formula: | C21 H20 Br Cl N6 O S |
Smiles: | C=CCn1c(CNc2ccc(cc2)[Cl])nnc1SCC(N/N=C/c1cccc(c1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 4.8279 |
logD: | 4.826 |
logSw: | -4.9939 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.075 |
InChI Key: | UYKAIGAHNDJXSA-UHFFFAOYSA-N |