platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide

C37H36F3N5Pt — CID 155650464

About platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide

platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide (PubChem CID 155650464) has the molecular formula C37H36F3N5Pt and a molecular weight of 808.84 g/mol. Its IUPAC name is platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide.

Molecular Properties

• Compound Name: platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide
• PubChem CID: 155650464
• Molecular Formula: C37H36F3N5Pt
• Molecular Weight: 808.84 g/mol
• Exact Mass: 808.29
• IUPAC Name: platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide
• SMILES: FC(F)(F)c1ccc2[n-]c3ccccc3c2c1.[2H]C([2H])([2H])N1C=CN(c2[c-]c(N[CH-]N(/C=C\C)C([2H])([2H])[2H])cc(-c3c(C)cc(C)cc3C)c2)[CH-]1.[Pt+4]
• InChI: InChI=1S/C24H29N4.C13H7F3N.Pt/c1-7-8-26(5)16-25-22-13-21(24-19(3)11-18(2)12-20(24)4)14-23(15-22)28-10-9-27(6)17-28;14-13(15,16)8-5-6-12-10(7-8)9-3-1-2-4-11(9)17-12;/h7-14,16-17,25H,1-6H3;1-7H;/q-3;-1;+4/b8-7-;;/i5D3,6D3
• InChIKey: FZCYTAVNOOQNBK-QWMCKWHNSA-N
• XLogP: 9.38
• TPSA: 35.85 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	808.84
LogP ≤ 5	9.38
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide?

The IUPAC name of platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide (CID 155650464) is platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide.

What is the SMILES notation for platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide?

The canonical SMILES for platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide is FC(F)(F)c1ccc2[n-]c3ccccc3c2c1.[2H]C([2H])([2H])N1C=CN(c2[c-]c(N[CH-]N(/C=C\C)C([2H])([2H])[2H])cc(-c3c(C)cc(C)cc3C)c2)[CH-]1.[Pt+4].

What is the InChIKey of platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide?

The InChIKey is FZCYTAVNOOQNBK-QWMCKWHNSA-N. The full InChI is InChI=1S/C24H29N4.C13H7F3N.Pt/c1-7-8-26(5)16-25-22-13-21(24-19(3)11-18(2)12-20(24)4)14-23(15-22)28-10-9-27(6)17-28;14-13(15,16)8-5-6-12-10(7-8)9-3-1-2-4-11(9)17-12;/h7-14,16-17,25H,1-6H3;1-7H;/q-3;-1;+4/b8-7-;;/i5D3,6D3;;.

What are the key properties of platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide?

platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide has a molecular weight of 808.84 g/mol, XLogP of 9.38, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for platinum(4+);N'-[(Z)-prop-1-enyl]-N'-(trideuteriomethyl)-N-[3-[3-(trideuteriomethyl)-2H-imidazol-2-id-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]methanediamine;3-(trifluoromethyl)carbazol-9-ide is sourced from PubChem (CID 155650464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).