2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

C25H19F5N4O2Pt — CID 59646001

About 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (PubChem CID 59646001) has the molecular formula C25H19F5N4O2Pt and a molecular weight of 697.52 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
• PubChem CID: 59646001
• Molecular Formula: C25H19F5N4O2Pt
• Molecular Weight: 697.52 g/mol
• Exact Mass: 697.11
• IUPAC Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
• SMILES: COc1cc(-c2[c-]cc(F)cc2F)nc(C(C)(C)c2cc(OC)cc(-n3[c-]cc(C(F)(F)F)n3)n2)c1.[Pt+2]
• InChI: InChI=1S/C25H19F5N4O2.Pt/c1-24(2,21-11-15(35-3)10-19(31-21)17-6-5-14(26)9-18(17)27)22-12-16(36-4)13-23(32-22)34-8-7-20(33-34)25(28,29)30;/h5,7,9-13H,1-4H3;/q-2;+2
• InChIKey: KDKZZTQLOLSGRG-UHFFFAOYSA-N
• XLogP: 5.57
• TPSA: 62.06 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	697.52
LogP ≤ 5	5.57
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (CID 59646001) is 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).

What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is COc1cc(-c2[c-]cc(F)cc2F)nc(C(C)(C)c2cc(OC)cc(-n3[c-]cc(C(F)(F)F)n3)n2)c1.[Pt+2].

What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The InChIKey is KDKZZTQLOLSGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19F5N4O2.Pt/c1-24(2,21-11-15(35-3)10-19(31-21)17-6-5-14(26)9-18(17)27)22-12-16(36-4)13-23(32-22)34-8-7-20(33-34)25(28,29)30;/h5,7,9-13H,1-4H3;/q-2;+2.

What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) has a molecular weight of 697.52 g/mol, XLogP of 5.57, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-6-[2-[4-methoxy-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is sourced from PubChem (CID 59646001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).