4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)

C144H114N50O2S4 — CID 159520704

About 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)

4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine) (PubChem CID 159520704) has the molecular formula C144H114N50O2S4 and a molecular weight of 2705.11 g/mol. Its IUPAC name is 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine).

Molecular Properties

• Compound Name: 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)
• PubChem CID: 159520704
• Molecular Formula: C144H114N50O2S4
• Molecular Weight: 2705.11 g/mol
• Exact Mass: 2702.92
• IUPAC Name: 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)
• SMILES: Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncc[nH]4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncc[nH]4)nc3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncco4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncco4)nc3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)nc3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)nc3)c2c1
• InChI: InChI=1S/2C18H15N7.2C18H14N6O.4C18H14N6S/c1-11-2-3-12-9-23-17(19)16(14(12)8-11)25-24-13-4-5-15(22-10-13)18-20-6-7-21-18;1-11-2-3-12-9-23-17(19)16(14(12)8-11)25-24-15-5-4-13(10-22-15)18-20-6-7-21-18;1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-13-4-5-15(21-10-13)18-20-6-7-25-18;1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-15-5-4-13(10-21-15)18-20-6-7-25-18;2*1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-13-4-5-15(21-10-13)18-20-6-7-25-18;2*1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-15-5-4-13(10-21-15)18-20-6-7-25-18/h2*2-10H,1H3,(H2,19,23)(H,20,21);6*2-10H,1H3,(H2,19,22)/b2*25-24+;6*24-23+
• InChIKey: MBTKKUUIHQDGHB-UXWFWRFXSA-N
• XLogP: 38.07
• TPSA: 773.14 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 54
• Rotatable Bonds: 24
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2705.11
LogP ≤ 5	38.07
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)?

The IUPAC name of 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine) (CID 159520704) is 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine).

What is the SMILES notation for 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)?

The canonical SMILES for 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine) is Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncc[nH]4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncc[nH]4)nc3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncco4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4ncco4)nc3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)cn3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)nc3)c2c1.Cc1ccc2cnc(N)c(/N=N/c3ccc(-c4nccs4)nc3)c2c1.

What is the InChIKey of 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)?

The InChIKey is MBTKKUUIHQDGHB-UXWFWRFXSA-N. The full InChI is InChI=1S/2C18H15N7.2C18H14N6O.4C18H14N6S/c1-11-2-3-12-9-23-17(19)16(14(12)8-11)25-24-13-4-5-15(22-10-13)18-20-6-7-21-18;1-11-2-3-12-9-23-17(19)16(14(12)8-11)25-24-15-5-4-13(10-22-15)18-20-6-7-21-18;1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-13-4-5-15(21-10-13)18-20-6-7-25-18;1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-15-5-4-13(10-21-15)18-20-6-7-25-18;2*1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-13-4-5-15(21-10-13)18-20-6-7-25-18;2*1-11-2-3-12-9-22-17(19)16(14(12)8-11)24-23-15-5-4-13(10-21-15)18-20-6-7-25-18/h2*2-10H,1H3,(H2,19,23)(H,20,21);6*2-10H,1H3,(H2,19,22)/b2*25-24+;6*24-23+.

What are the key properties of 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine)?

4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine) has a molecular weight of 2705.11 g/mol, XLogP of 38.07, 24 rotatable bonds, 10 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[5-(1H-imidazol-2-yl)-2-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;4-[[6-(1H-imidazol-2-yl)-3-pyridinyl]diazenyl]-6-methylisoquinolin-3-amine;6-methyl-4-[[5-(1,3-oxazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine;6-methyl-4-[[6-(1,3-oxazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine;bis(6-methyl-4-[[5-(1,3-thiazol-2-yl)-2-pyridinyl]diazenyl]isoquinolin-3-amine);bis(6-methyl-4-[[6-(1,3-thiazol-2-yl)-3-pyridinyl]diazenyl]isoquinolin-3-amine) is sourced from PubChem (CID 159520704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).