N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)

C50H53N5O2PtS — CID 155650490

About N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)

N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+) (PubChem CID 155650490) has the molecular formula C50H53N5O2PtS and a molecular weight of 983.15 g/mol. Its IUPAC name is N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+).

Molecular Properties

• Compound Name: N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)
• PubChem CID: 155650490
• Molecular Formula: C50H53N5O2PtS
• Molecular Weight: 983.15 g/mol
• Exact Mass: 982.36
• IUPAC Name: N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)
• SMILES: Cc1ccccc1N(C)[CH-]Nc1[c-]c(N2[CH-]N(C)c3ccccc32)cc(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1.O=S1(=O)c2ccccc2[N-]c2ccccc21.[Pt+4]
• InChI: InChI=1S/C38H45N4.C12H8NO2S.Pt/c1-25(2)29-20-33(26(3)4)38(34(21-29)27(5)6)30-18-31(39-23-40(8)35-15-11-10-14-28(35)7)22-32(19-30)42-24-41(9)36-16-12-13-17-37(36)42;14-16(15)11-7-3-1-5-9(11)13-10-6-2-4-8-12(10)16;/h10-21,23-27,39H,1-9H3;1-8H;/q-3;-1;+4
• InChIKey: XUEUXBJFWFTVTH-UHFFFAOYSA-N
• XLogP: 13.37
• TPSA: 69.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 59
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	983.15
LogP ≤ 5	13.37
H-Bond Donors ≤ 5	1
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 N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)?

The IUPAC name of N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+) (CID 155650490) is N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+).

What is the SMILES notation for N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)?

The canonical SMILES for N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+) is Cc1ccccc1N(C)[CH-]Nc1[c-]c(N2[CH-]N(C)c3ccccc32)cc(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1.O=S1(=O)c2ccccc2[N-]c2ccccc21.[Pt+4].

What is the InChIKey of N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)?

The InChIKey is XUEUXBJFWFTVTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H45N4.C12H8NO2S.Pt/c1-25(2)29-20-33(26(3)4)38(34(21-29)27(5)6)30-18-31(39-23-40(8)35-15-11-10-14-28(35)7)22-32(19-30)42-24-41(9)36-16-12-13-17-37(36)42;14-16(15)11-7-3-1-5-9(11)13-10-6-2-4-8-12(10)16;/h10-21,23-27,39H,1-9H3;1-8H;/q-3;-1;+4.

What are the key properties of N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+)?

N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+) has a molecular weight of 983.15 g/mol, XLogP of 13.37, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N'-methyl-N-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)-5-[2,4,6-tri(propan-2-yl)phenyl]benzene-2-id-1-yl]-N'-(2-methylphenyl)methanediamine;phenothiazin-10-ide 5,5-dioxide;platinum(4+) is sourced from PubChem (CID 155650490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).