7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)

C56H52F6N2OPtS2 — CID 177073438

About 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)

7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+) (PubChem CID 177073438) has the molecular formula C56H52F6N2OPtS2 and a molecular weight of 1142.24 g/mol. Its IUPAC name is 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)
• PubChem CID: 177073438
• Molecular Formula: C56H52F6N2OPtS2
• Molecular Weight: 1142.24 g/mol
• Exact Mass: 1141.31
• IUPAC Name: 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)
• SMILES: CC(C)(C)c1ccc(-c2cc3c(C(F)(F)F)cnc(-c4[c-]c(Oc5[c-]c(-c6ncc(C(F)(F)F)c7cc(-c8ccc(C(C)(C)C)cc8)sc67)cc(C(C)(C)C)c5)cc(C(C)(C)C)c4)c3s2)cc1.[Pt+2]
• InChI: InChI=1S/C56H52F6N2OS2.Pt/c1-51(2,3)35-17-13-31(14-18-35)45-27-41-43(55(57,58)59)29-63-47(49(41)66-45)33-21-37(53(7,8)9)25-39(23-33)65-40-24-34(22-38(26-40)54(10,11)12)48-50-42(44(30-64-48)56(60,61)62)28-46(67-50)32-15-19-36(20-16-32)52(4,5)6;/h13-22,25-30H,1-12H3;/q-2;+2
• InChIKey: ZDXWLUOYYXFVSX-UHFFFAOYSA-N
• XLogP: 18.19
• TPSA: 35.01 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1142.24
LogP ≤ 5	18.19
H-Bond Donors ≤ 5	0
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 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)?

The IUPAC name of 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+) (CID 177073438) is 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+).

What is the SMILES notation for 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)?

The canonical SMILES for 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+) is CC(C)(C)c1ccc(-c2cc3c(C(F)(F)F)cnc(-c4[c-]c(Oc5[c-]c(-c6ncc(C(F)(F)F)c7cc(-c8ccc(C(C)(C)C)cc8)sc67)cc(C(C)(C)C)c5)cc(C(C)(C)C)c4)c3s2)cc1.[Pt+2].

What is the InChIKey of 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)?

The InChIKey is ZDXWLUOYYXFVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H52F6N2OS2.Pt/c1-51(2,3)35-17-13-31(14-18-35)45-27-41-43(55(57,58)59)29-63-47(49(41)66-45)33-21-37(53(7,8)9)25-39(23-33)65-40-24-34(22-38(26-40)54(10,11)12)48-50-42(44(30-64-48)56(60,61)62)28-46(67-50)32-15-19-36(20-16-32)52(4,5)6;/h13-22,25-30H,1-12H3;/q-2;+2.

What are the key properties of 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+)?

7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+) has a molecular weight of 1142.24 g/mol, XLogP of 18.19, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[3-tert-butyl-5-[3-tert-butyl-5-[2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridin-7-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-(4-tert-butylphenyl)-4-(trifluoromethyl)thieno[2,3-c]pyridine;platinum(2+) is sourced from PubChem (CID 177073438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).