(2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)

C91H84B2BrClN6O4Pt — CID 158759448

About (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)

(2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+) (PubChem CID 158759448) has the molecular formula C91H84B2BrClN6O4Pt and a molecular weight of 1657.77 g/mol. Its IUPAC name is (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+).

Molecular Properties

• Compound Name: (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)
• PubChem CID: 158759448
• Molecular Formula: C91H84B2BrClN6O4Pt
• Molecular Weight: 1657.77 g/mol
• Exact Mass: 1655.53
• IUPAC Name: (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)
• SMILES: Cc1cnc(-c2[c-]c(-c3ccccc3-c3[c-]c(-c4cc(C)c(C)cn4)ccc3)ccc2)cc1C.Cc1cnc(-c2cccc(-c3ccccc3-c3cccc(-c4ccc(C(C)C)cn4)c3)c2)cc1C.Cc1cnc(-c2cccc(Br)c2)cc1C.Cc1cnc(Cl)cc1C.OB(O)c1ccccc1B(O)O.[Pt+2]
• InChI: InChI=1S/C33H30N2.C32H26N2.C13H12BrN.C7H8ClN.C6H8B2O4.Pt/c1-22(2)29-15-16-32(35-21-29)27-11-7-9-25(18-27)30-13-5-6-14-31(30)26-10-8-12-28(19-26)33-17-23(3)24(4)20-34-33;1-21-15-31(33-19-23(21)3)27-11-7-9-25(17-27)29-13-5-6-14-30(29)26-10-8-12-28(18-26)32-16-22(2)24(4)20-34-32;1-9-6-13(15-8-10(9)2)11-4-3-5-12(14)7-11;1-5-3-7(8)9-4-6(5)2;9-7(10)5-3-1-2-4-6(5)8(11)12;/h5-22H,1-4H3;5-16,19-20H,1-4H3;3-8H,1-2H3;3-4H,1-2H3;1-4,9-12H;/q;-2;;;;+2
• InChIKey: CRTDCDOLCDXVRS-UHFFFAOYSA-N
• XLogP: 20.39
• TPSA: 158.26 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 10
• Rotatable Bonds: 12
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1657.77
LogP ≤ 5	20.39
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)?

The IUPAC name of (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+) (CID 158759448) is (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+).

What is the SMILES notation for (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)?

The canonical SMILES for (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+) is Cc1cnc(-c2[c-]c(-c3ccccc3-c3[c-]c(-c4cc(C)c(C)cn4)ccc3)ccc2)cc1C.Cc1cnc(-c2cccc(-c3ccccc3-c3cccc(-c4ccc(C(C)C)cn4)c3)c2)cc1C.Cc1cnc(-c2cccc(Br)c2)cc1C.Cc1cnc(Cl)cc1C.OB(O)c1ccccc1B(O)O.[Pt+2].

What is the InChIKey of (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)?

The InChIKey is CRTDCDOLCDXVRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H30N2.C32H26N2.C13H12BrN.C7H8ClN.C6H8B2O4.Pt/c1-22(2)29-15-16-32(35-21-29)27-11-7-9-25(18-27)30-13-5-6-14-31(30)26-10-8-12-28(19-26)33-17-23(3)24(4)20-34-33;1-21-15-31(33-19-23(21)3)27-11-7-9-25(17-27)29-13-5-6-14-30(29)26-10-8-12-28(18-26)32-16-22(2)24(4)20-34-32;1-9-6-13(15-8-10(9)2)11-4-3-5-12(14)7-11;1-5-3-7(8)9-4-6(5)2;9-7(10)5-3-1-2-4-6(5)8(11)12;/h5-22H,1-4H3;5-16,19-20H,1-4H3;3-8H,1-2H3;3-4H,1-2H3;1-4,9-12H;/q;-2;;;;+2.

What are the key properties of (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+)?

(2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+) has a molecular weight of 1657.77 g/mol, XLogP of 20.39, 12 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for (2-boronophenyl)boronic acid;2-(3-bromophenyl)-4,5-dimethylpyridine;2-chloro-4,5-dimethylpyridine;4,5-dimethyl-2-[3-[2-[3-(5-propan-2-yl-2-pyridinyl)phenyl]phenyl]phenyl]pyridine;2-[3-[2-[3-(4,5-dimethyl-2-pyridinyl)benzene-2-id-1-yl]phenyl]benzene-2-id-1-yl]-4,5-dimethylpyridine;platinum(2+) is sourced from PubChem (CID 158759448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).