1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))

C140H160Fe3N56O4 — CID 162006742

About 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))

1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+)) (PubChem CID 162006742) has the molecular formula C140H160Fe3N56O4 and a molecular weight of 2858.74 g/mol. Its IUPAC name is 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+)).

Molecular Properties

• Compound Name: 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))
• PubChem CID: 162006742
• Molecular Formula: C140H160Fe3N56O4
• Molecular Weight: 2858.74 g/mol
• Exact Mass: 2857.21
• IUPAC Name: 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))
• SMILES: CC(C)c1nn2nc(C(C)(C)C)c(/N=N/c3c(C#N)c(C(C)(C)C)nn3-c3ccccn3)c2[n-]1.CCCCn1c(O)c(/N=N\c2c(C#N)c(C(C)(C)C)nn2-c2ccccn2)c(C)c(C#N)c1=O.Cc1nn2nc(C(C)(C)C)c(/N=N/c3c(C#N)c(C(C)(C)C)nn3-c3ccccn3)c2[n-]1.[C-]#[N+]c1c(C(C)(C)C)nn(-c2ccccn2)c1/N=N/c1c(C(C)(C)C)nn2nc(C(C)C)[n-]c12.[C-]#[N+]c1c(C(C)(C)C)nn(-c2ccccn2)c1/N=N/c1c(C(C)(C)C)nn2nc(C)[n-]c12.[C-]#[N+]c1c(C(C)(C)C)nn(-c2ccccn2)c1/N=N/c1c(C)c([N+]#[C-])c(=O)n(CCCC)c1O.[Fe+2].[Fe+2].[Fe]
• InChI: InChI=1S/2C24H29N10.2C24H26N8O2.2C22H25N10.3Fe/c1-14(2)20-27-21-17(19(24(6,7)8)31-34(21)32-20)28-29-22-16(25-9)18(23(3,4)5)30-33(22)15-12-10-11-13-26-15;1-14(2)20-27-22-17(19(24(6,7)8)31-34(22)32-20)28-29-21-15(13-25)18(23(3,4)5)30-33(21)16-11-9-10-12-26-16;1-8-9-14-31-22(33)17(25-6)15(2)18(23(31)34)28-29-21-19(26-7)20(24(3,4)5)30-32(21)16-12-10-11-13-27-16;1-6-7-12-31-22(33)16(13-25)15(2)19(23(31)34)28-29-21-17(14-26)20(24(3,4)5)30-32(21)18-10-8-9-11-27-18;1-13-25-19-16(18(22(5,6)7)30-32(19)28-13)26-27-20-15(23-8)17(21(2,3)4)29-31(20)14-11-9-10-12-24-14;1-13-25-20-16(18(22(5,6)7)30-32(20)28-13)26-27-19-14(12-23)17(21(2,3)4)29-31(19)15-10-8-9-11-24-15;;;/h10-14H,1-8H3;9-12,14H,1-8H3;10-13,34H,8-9,14H2,1-5H3;8-11,34H,6-7,12H2,1-5H3;9-12H,1-7H3;8-11H,1-7H3;;;/q2*-1;;;2*-1;;2*+2/b3*29-28+;29-28-;2*27-26+
• InChIKey: MFWPGXAISPSKDF-MRTMNMNCSA-N
• XLogP: 31.57
• TPSA: 706.80 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 52
• Rotatable Bonds: 26
• Heavy Atoms: 203
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2858.74
LogP ≤ 5	31.57
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	52

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))?

The IUPAC name of 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+)) (CID 162006742) is 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+)).

What is the SMILES notation for 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))?

The canonical SMILES for 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+)) is CC(C)c1nn2nc(C(C)(C)C)c(/N=N/c3c(C#N)c(C(C)(C)C)nn3-c3ccccn3)c2[n-]1.CCCCn1c(O)c(/N=N\c2c(C#N)c(C(C)(C)C)nn2-c2ccccn2)c(C)c(C#N)c1=O.Cc1nn2nc(C(C)(C)C)c(/N=N/c3c(C#N)c(C(C)(C)C)nn3-c3ccccn3)c2[n-]1.[C-]#[N+]c1c(C(C)(C)C)nn(-c2ccccn2)c1/N=N/c1c(C(C)(C)C)nn2nc(C(C)C)[n-]c12.[C-]#[N+]c1c(C(C)(C)C)nn(-c2ccccn2)c1/N=N/c1c(C(C)(C)C)nn2nc(C)[n-]c12.[C-]#[N+]c1c(C(C)(C)C)nn(-c2ccccn2)c1/N=N/c1c(C)c([N+]#[C-])c(=O)n(CCCC)c1O.[Fe+2].[Fe+2].[Fe].

What is the InChIKey of 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))?

The InChIKey is MFWPGXAISPSKDF-MRTMNMNCSA-N. The full InChI is InChI=1S/2C24H29N10.2C24H26N8O2.2C22H25N10.3Fe/c1-14(2)20-27-21-17(19(24(6,7)8)31-34(21)32-20)28-29-22-16(25-9)18(23(3,4)5)30-33(22)15-12-10-11-13-26-15;1-14(2)20-27-22-17(19(24(6,7)8)31-34(22)32-20)28-29-21-15(13-25)18(23(3,4)5)30-33(21)16-11-9-10-12-26-16;1-8-9-14-31-22(33)17(25-6)15(2)18(23(31)34)28-29-21-19(26-7)20(24(3,4)5)30-32(21)16-12-10-11-13-27-16;1-6-7-12-31-22(33)16(13-25)15(2)19(23(31)34)28-29-21-17(14-26)20(24(3,4)5)30-32(21)18-10-8-9-11-27-18;1-13-25-19-16(18(22(5,6)7)30-32(19)28-13)26-27-20-15(23-8)17(21(2,3)4)29-31(20)14-11-9-10-12-24-14;1-13-25-20-16(18(22(5,6)7)30-32(20)28-13)26-27-19-14(12-23)17(21(2,3)4)29-31(19)15-10-8-9-11-24-15;;;/h10-14H,1-8H3;9-12,14H,1-8H3;10-13,34H,8-9,14H2,1-5H3;8-11,34H,6-7,12H2,1-5H3;9-12H,1-7H3;8-11H,1-7H3;;;/q2*-1;;;2*-1;;2*+2/b3*29-28+;29-28-;2*27-26+;;;.

What are the key properties of 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+))?

1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+)) has a molecular weight of 2858.74 g/mol, XLogP of 31.57, 26 rotatable bonds, 2 hydrogen bond donors, and 52 hydrogen bond acceptors.

Where does this data come from?

All data for 1-butyl-5-[(3-tert-butyl-4-cyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-4-methyl-2-oxopyridine-3-carbonitrile;1-butyl-5-[(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-6-hydroxy-3-isocyano-4-methylpyridin-2-one;3-tert-butyl-5-[(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;3-tert-butyl-5-[(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazenyl]-1-pyridin-2-ylpyrazole-4-carbonitrile;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-methyl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;(3-tert-butyl-4-isocyano-1-pyridin-2-ylpyrazol-5-yl)-(7-tert-butyl-3-propan-2-yl-1,2,8-triaza-4-azanidabicyclo[3.3.0]octa-2,5,7-trien-6-yl)diazene;iron;bis(iron(2+)) is sourced from PubChem (CID 162006742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).