4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum

C56H65N4OPt-3 — CID 169056487

About 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum

4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum (PubChem CID 169056487) has the molecular formula C56H65N4OPt-3 and a molecular weight of 1005.24 g/mol. Its IUPAC name is 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum.

Molecular Properties

• Compound Name: 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum
• PubChem CID: 169056487
• Molecular Formula: C56H65N4OPt-3
• Molecular Weight: 1005.24 g/mol
• Exact Mass: 1004.48
• IUPAC Name: 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum
• SMILES: [CH2-]N(c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)cc(C(C)(C)C)c1)c1cc(C(C)(C)C)ccc1Nc1cc(C(C)(C)C)cc(C(C)(C)C)c1.[Pt]
• InChI: InChI=1S/C56H65N4O.Pt/c1-52(2,3)36-21-24-47(58-41-28-38(54(7,8)9)27-39(29-41)55(10,11)12)50(32-36)59(16)42-30-40(56(13,14)15)31-44(34-42)61-43-22-23-46-45-19-17-18-20-48(45)60(49(46)35-43)51-33-37(25-26-57-51)53(4,5)6;/h17-33,58H,16H2,1-15H3;/q-3
• InChIKey: FVXFMUBXCJZKFC-UHFFFAOYSA-N
• XLogP: 15.73
• TPSA: 42.32 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 62
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1005.24
LogP ≤ 5	15.73
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum?

The IUPAC name of 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum (CID 169056487) is 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum.

What is the SMILES notation for 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum?

The canonical SMILES for 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum is [CH2-]N(c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)cc(C(C)(C)C)c1)c1cc(C(C)(C)C)ccc1Nc1cc(C(C)(C)C)cc(C(C)(C)C)c1.[Pt].

What is the InChIKey of 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum?

The InChIKey is FVXFMUBXCJZKFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H65N4O.Pt/c1-52(2,3)36-21-24-47(58-41-28-38(54(7,8)9)27-39(29-41)55(10,11)12)50(32-36)59(16)42-30-40(56(13,14)15)31-44(34-42)61-43-22-23-46-45-19-17-18-20-48(45)60(49(46)35-43)51-33-37(25-26-57-51)53(4,5)6;/h17-33,58H,16H2,1-15H3;/q-3;.

What are the key properties of 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum?

4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum has a molecular weight of 1005.24 g/mol, XLogP of 15.73, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2-N-[3-tert-butyl-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-6-id-1-yl]-1-N-(3,5-ditert-butylphenyl)-2-N-methanidylbenzene-1,2-diamine;platinum is sourced from PubChem (CID 169056487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).