2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

C25H19F9N6OPt — CID 58444851

About 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (PubChem CID 58444851) has the molecular formula C25H19F9N6OPt and a molecular weight of 785.53 g/mol. Its IUPAC name is 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
• PubChem CID: 58444851
• Molecular Formula: C25H19F9N6OPt
• Molecular Weight: 785.53 g/mol
• Exact Mass: 785.11
• IUPAC Name: 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
• SMILES: COc1cc(-n2[c-]c(C(F)(F)F)nc2C(F)(F)F)nc(C(C)(C)c2cc(C)cc(-n3[c-]c(C(F)(F)F)nc3C)n2)c1.[Pt+2]
• InChI: InChI=1S/C25H19F9N6O.Pt/c1-12-6-15(36-19(7-12)39-10-17(23(26,27)28)35-13(39)2)22(3,4)16-8-14(41-5)9-20(37-16)40-11-18(24(29,30)31)38-21(40)25(32,33)34;/h6-9H,1-5H3;/q-2;+2
• InChIKey: OZCNZVILVWKJKC-UHFFFAOYSA-N
• XLogP: 6.45
• TPSA: 70.65 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	785.53
LogP ≤ 5	6.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The IUPAC name of 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (CID 58444851) is 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).

What is the SMILES notation for 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The canonical SMILES for 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is COc1cc(-n2[c-]c(C(F)(F)F)nc2C(F)(F)F)nc(C(C)(C)c2cc(C)cc(-n3[c-]c(C(F)(F)F)nc3C)n2)c1.[Pt+2].

What is the InChIKey of 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The InChIKey is OZCNZVILVWKJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19F9N6O.Pt/c1-12-6-15(36-19(7-12)39-10-17(23(26,27)28)35-13(39)2)22(3,4)16-8-14(41-5)9-20(37-16)40-11-18(24(29,30)31)38-21(40)25(32,33)34;/h6-9H,1-5H3;/q-2;+2.

What are the key properties of 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) has a molecular weight of 785.53 g/mol, XLogP of 6.45, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2,5-bis(trifluoromethyl)-4H-imidazol-4-id-3-yl]-4-methoxy-6-[2-[4-methyl-6-[2-methyl-5-(trifluoromethyl)-4H-imidazol-4-id-3-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is sourced from PubChem (CID 58444851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).