Di-2-pyridylketone 4-cyclohexyl-4-methyl-3-thiosemicarbazone
1-cyclohexyl-3-(dipyridin-2-ylmethylideneamino)-1-methylthiourea
Molecular Identity
Di-2-pyridylketone 4-cyclohexyl-4-methyl-3-thiosemicarbazone
1-cyclohexyl-3-(dipyridin-2-ylmethylideneamino)-1-methylthiourea
PubChem CID: 57380301
2D Structure
Properties
C19H23N5S
Molecular Formula
353.50
Molecular Weight
g/mol
353.1674
Exact Mass
Da
4
XLogP
Drug-like (Lipinski: < 5)
85.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
441
Complexity
SMILES
Canonical SMILES
SMILES: CN(C1CCCCC1)C(=S)NN=C(C2=CC=CC=N2)C3=CC=CC=N3Isomeric SMILES
SMILES: CN(C1CCCCC1)C(=S)NN=C(C2=CC=CC=N2)C3=CC=CC=N3Synonyms(20)
1382469-39-7DP4cych4mtDi-2-pyridylketone 4-cyclohexyl-4-methyl-3-thiosemicarbazone6068Z4Y7QIRefChem:1324861-((bis(pyridin-2-yl)methylidene)amino)-3-cyclohexyl-3-methylthioureaDPCN-Cyclohexyl-2-(di(pyridin-2-yl)methylene)-N-methylhydrazinecarbothioamideCHEMBL2203744di-2-pyridylketone-4-cyclohexyl-4-methyl-3-thiosemicarbazoneN-Cyclohexyl-2-(di-2-pyridinylmethylene)-N-methylhydrazinecarbothioamideUNII-6068Z4Y7QIorb1819040SCHEMBL9971653SCHEMBL31222549
Data from PubChem (NCBI)
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Molecular Structure
Di-2-pyridylketone 4-cyclohexyl-4-methyl-3-thiosemicarbazone
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Drug Network
Trials and conditions connected to Di-2-pyridylketone 4-cyclohexyl-4-methyl-3-thiosemicarbazone
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