2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)

C46H32F5N7Pt — CID 58831103

About 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)

2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) (PubChem CID 58831103) has the molecular formula C46H32F5N7Pt and a molecular weight of 972.88 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+).

Molecular Properties

• Compound Name: 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)
• PubChem CID: 58831103
• Molecular Formula: C46H32F5N7Pt
• Molecular Weight: 972.88 g/mol
• Exact Mass: 972.23
• IUPAC Name: 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)
• SMILES: CC(C)(c1cc(N(c2ccccc2)c2ccccc2)cc(-c2nc(C(F)(F)F)n[n-]2)n1)c1cc(N(c2ccccc2)c2ccccc2)cc(-c2[c-]cc(F)cc2F)n1.[Pt+2]
• InChI: InChI=1S/C46H32F5N7.Pt/c1-45(2,41-28-35(26-39(52-41)37-24-23-30(47)25-38(37)48)57(31-15-7-3-8-16-31)32-17-9-4-10-18-32)42-29-36(27-40(53-42)43-54-44(56-55-43)46(49,50)51)58(33-19-11-5-12-20-33)34-21-13-6-14-22-34;/h3-23,25-29H,1-2H3;/q-2;+2
• InChIKey: PRKWGJIFYZPHJQ-UHFFFAOYSA-N
• XLogP: 11.92
• TPSA: 72.14 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 10
• Heavy Atoms: 59
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	972.88
LogP ≤ 5	11.92
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)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) (CID 58831103) is 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+).

What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) is CC(C)(c1cc(N(c2ccccc2)c2ccccc2)cc(-c2nc(C(F)(F)F)n[n-]2)n1)c1cc(N(c2ccccc2)c2ccccc2)cc(-c2[c-]cc(F)cc2F)n1.[Pt+2].

What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

The InChIKey is PRKWGJIFYZPHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H32F5N7.Pt/c1-45(2,41-28-35(26-39(52-41)37-24-23-30(47)25-38(37)48)57(31-15-7-3-8-16-31)32-17-9-4-10-18-32)42-29-36(27-40(53-42)43-54-44(56-55-43)46(49,50)51)58(33-19-11-5-12-20-33)34-21-13-6-14-22-34;/h3-23,25-29H,1-2H3;/q-2;+2.

What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

2-(2,4-difluorobenzene-6-id-1-yl)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) has a molecular weight of 972.88 g/mol, XLogP of 11.92, 10 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)-N,N-diphenyl-6-[2-[4-(N-phenylanilino)-6-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) is sourced from PubChem (CID 58831103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).