1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))

C108H83N19OPt5S2 — CID 158112461

About 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))

1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+)) (PubChem CID 158112461) has the molecular formula C108H83N19OPt5S2 and a molecular weight of 2702.51 g/mol. Its IUPAC name is 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+)).

Molecular Properties

• Compound Name: 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))
• PubChem CID: 158112461
• Molecular Formula: C108H83N19OPt5S2
• Molecular Weight: 2702.51 g/mol
• Exact Mass: 2700.47
• IUPAC Name: 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))
• SMILES: Cc1c[c-]c(-n2cccn2)cc1.Cn1ccnc1-c1[c-]ccc(-c2ccccc2)c1.Cn1ccnc1-c1[c-]csc1-c1ccccc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1ccccc1-c1ncco1.[c-]1ccccc1-c1nccs1.[c-]1ccccc1-n1cc(-c2ccccc2)cn1.[c-]1ccccc1-n1cccn1.[c-]1ccccc1-n1cccn1.[c-]1ccccc1-n1cccn1.[c-]1ccccc1-n1cncn1
• InChI: InChI=1S/C16H13N2.C15H11N2.C14H11N2S.C10H9N2.3C9H7N2.C9H6NO.C9H6NS.C8H6N3.5Pt/c1-18-11-10-17-16(18)15-9-5-8-14(12-15)13-6-3-2-4-7-13;1-3-7-13(8-4-1)14-11-16-17(12-14)15-9-5-2-6-10-15;1-16-9-8-15-14(16)12-7-10-17-13(12)11-5-3-2-4-6-11;1-9-3-5-10(6-4-9)12-8-2-7-11-12;3*1-2-5-9(6-3-1)11-8-4-7-10-11;2*1-2-4-8(5-3-1)9-10-6-7-11-9;1-2-4-8(5-3-1)11-7-9-6-10-11;;;;;/h2-8,10-12H,1H3;1-9,11-12H;2-6,8-10H,1H3;2-5,7-8H,1H3;3*1-5,7-8H;3*1-4,6-7H;;;;;/q10*-1;5*+2
• InChIKey: KZOLZFLHNRMRKQ-UHFFFAOYSA-N
• XLogP: 23.32
• TPSA: 194.37 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 13
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2702.51
LogP ≤ 5	23.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))?

The IUPAC name of 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+)) (CID 158112461) is 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+)).

What is the SMILES notation for 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))?

The canonical SMILES for 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+)) is Cc1c[c-]c(-n2cccn2)cc1.Cn1ccnc1-c1[c-]ccc(-c2ccccc2)c1.Cn1ccnc1-c1[c-]csc1-c1ccccc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1ccccc1-c1ncco1.[c-]1ccccc1-c1nccs1.[c-]1ccccc1-n1cc(-c2ccccc2)cn1.[c-]1ccccc1-n1cccn1.[c-]1ccccc1-n1cccn1.[c-]1ccccc1-n1cccn1.[c-]1ccccc1-n1cncn1.

What is the InChIKey of 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))?

The InChIKey is KZOLZFLHNRMRKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N2.C15H11N2.C14H11N2S.C10H9N2.3C9H7N2.C9H6NO.C9H6NS.C8H6N3.5Pt/c1-18-11-10-17-16(18)15-9-5-8-14(12-15)13-6-3-2-4-7-13;1-3-7-13(8-4-1)14-11-16-17(12-14)15-9-5-2-6-10-15;1-16-9-8-15-14(16)12-7-10-17-13(12)11-5-3-2-4-6-11;1-9-3-5-10(6-4-9)12-8-2-7-11-12;3*1-2-5-9(6-3-1)11-8-4-7-10-11;2*1-2-4-8(5-3-1)9-10-6-7-11-9;1-2-4-8(5-3-1)11-7-9-6-10-11;;;;;/h2-8,10-12H,1H3;1-9,11-12H;2-6,8-10H,1H3;2-5,7-8H,1H3;3*1-5,7-8H;3*1-4,6-7H;;;;;/q10*-1;5*+2.

What are the key properties of 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+))?

1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+)) has a molecular weight of 2702.51 g/mol, XLogP of 23.32, 13 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-methylbenzene-6-id-1-yl)pyrazole;1-methyl-2-(3-phenylbenzene-6-id-1-yl)imidazole;1-methyl-2-(5-phenyl-3H-thiophen-3-id-4-yl)imidazole;2-phenyl-1,3-oxazole;4-phenyl-1-phenylpyrazole;tris(1-phenylpyrazole);2-phenyl-1,3-thiazole;1-phenyl-1,2,4-triazole;pentakis(platinum(2+)) is sourced from PubChem (CID 158112461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).