tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))

C79H75F9N24Pt3 — CID 157445286

About tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))

tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+)) (PubChem CID 157445286) has the molecular formula C79H75F9N24Pt3 and a molecular weight of 2116.85 g/mol. Its IUPAC name is tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+)).

Molecular Properties

• Compound Name: tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))
• PubChem CID: 157445286
• Molecular Formula: C79H75F9N24Pt3
• Molecular Weight: 2116.85 g/mol
• Exact Mass: 2115.54
• IUPAC Name: tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))
• SMILES: CC(C)(C)c1ccc2c(-c3cc(C(F)(F)F)n[n-]3)nccc2c1.CC(C)(C)c1ccc2c(-c3cc(C(F)(F)F)n[n-]3)nccc2c1.CC(C)(C)c1ccc2c(-c3cc(C(F)(F)F)n[n-]3)nccc2c1.Cc1n[n-]c(-c2nccn2-c2ccccc2)n1.Cc1n[n-]c(-c2nccn2C(C)C)n1.Cc1n[n-]c(-c2nccn2C)n1.[Pt+2].[Pt+2].[Pt+2]
• InChI: InChI=1S/3C17H15F3N3.C12H10N5.C9H12N5.C7H8N5.3Pt/c3*1-16(2,3)11-4-5-12-10(8-11)6-7-21-15(12)13-9-14(23-22-13)17(18,19)20;1-9-14-11(16-15-9)12-13-7-8-17(12)10-5-3-2-4-6-10;1-6(2)14-5-4-10-9(14)8-11-7(3)12-13-8;1-5-9-6(11-10-5)7-8-3-4-12(7)2;;;/h3*4-9H,1-3H3;2-8H,1H3;4-6H,1-3H3;3-4H,1-2H3;;;/q6*-1;3*+2
• InChIKey: BSDKYIUNXYLXMW-UHFFFAOYSA-N
• XLogP: 16.63
• TPSA: 292.74 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 8
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2116.85
LogP ≤ 5	16.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))?

The IUPAC name of tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+)) (CID 157445286) is tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+)).

What is the SMILES notation for tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))?

The canonical SMILES for tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+)) is CC(C)(C)c1ccc2c(-c3cc(C(F)(F)F)n[n-]3)nccc2c1.CC(C)(C)c1ccc2c(-c3cc(C(F)(F)F)n[n-]3)nccc2c1.CC(C)(C)c1ccc2c(-c3cc(C(F)(F)F)n[n-]3)nccc2c1.Cc1n[n-]c(-c2nccn2-c2ccccc2)n1.Cc1n[n-]c(-c2nccn2C(C)C)n1.Cc1n[n-]c(-c2nccn2C)n1.[Pt+2].[Pt+2].[Pt+2].

What is the InChIKey of tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))?

The InChIKey is BSDKYIUNXYLXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C17H15F3N3.C12H10N5.C9H12N5.C7H8N5.3Pt/c3*1-16(2,3)11-4-5-12-10(8-11)6-7-21-15(12)13-9-14(23-22-13)17(18,19)20;1-9-14-11(16-15-9)12-13-7-8-17(12)10-5-3-2-4-6-10;1-6(2)14-5-4-10-9(14)8-11-7(3)12-13-8;1-5-9-6(11-10-5)7-8-3-4-12(7)2;;;/h3*4-9H,1-3H3;2-8H,1H3;4-6H,1-3H3;3-4H,1-2H3;;;/q6*-1;3*+2.

What are the key properties of tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+))?

tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+)) has a molecular weight of 2116.85 g/mol, XLogP of 16.63, 8 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for tris(6-tert-butyl-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline);3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+)) is sourced from PubChem (CID 157445286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).