2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)

C101H100BrN13O4Pt2 — CID 157392472

About 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)

2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+) (PubChem CID 157392472) has the molecular formula C101H100BrN13O4Pt2 and a molecular weight of 2030.06 g/mol. Its IUPAC name is 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+).

Molecular Properties

• Compound Name: 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)
• PubChem CID: 157392472
• Molecular Formula: C101H100BrN13O4Pt2
• Molecular Weight: 2030.06 g/mol
• Exact Mass: 2027.65
• IUPAC Name: 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)
• SMILES: CC(C)(C)N=[Pt]=O.CC(C)(C)c1ccnc(Br)c1.Cc1cc(C(C)(C)C)cc(-n2c3[c-]c(Oc4[c-]c(-n5nc(C)cc5C)ccc4)ccc3c3ccccc32)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c(c3)[nH]c3ccccc34)c2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c5ccccc5n(-c5cc(C(C)(C)C)ccn5)c4c3)c2)n1.[Pt+2]
• InChI: InChI=1S/C33H30N4O.C32H30N4O.C23H19N3O.C9H12BrN.C4H9N.O.2Pt/c1-21-17-24(33(4,5)6)18-32(34-21)36-30-13-8-7-12-28(30)29-15-14-27(20-31(29)36)38-26-11-9-10-25(19-26)37-23(3)16-22(2)35-37;1-21-17-22(2)36(34-21)24-9-8-10-25(19-24)37-26-13-14-28-27-11-6-7-12-29(27)35(30(28)20-26)31-18-23(15-16-33-31)32(3,4)5;1-15-12-16(2)26(25-15)17-6-5-7-18(13-17)27-19-10-11-21-20-8-3-4-9-22(20)24-23(21)14-19;1-9(2,3)7-4-5-11-8(10)6-7;1-4(2,3)5;;;/h7-18H,1-6H3;6-20H,1-5H3;3-14,24H,1-2H3;4-6H,1-3H3;1-3H3;;;/q-2;;;;;;;+2
• InChIKey: MRHXJNDKVVDKHP-UHFFFAOYSA-N
• XLogP: 26.50
• TPSA: 174.90 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 16
• Rotatable Bonds: 11
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2030.06
LogP ≤ 5	26.50
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)?

The IUPAC name of 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+) (CID 157392472) is 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+).

What is the SMILES notation for 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)?

The canonical SMILES for 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+) is CC(C)(C)N=[Pt]=O.CC(C)(C)c1ccnc(Br)c1.Cc1cc(C(C)(C)C)cc(-n2c3[c-]c(Oc4[c-]c(-n5nc(C)cc5C)ccc4)ccc3c3ccccc32)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c(c3)[nH]c3ccccc34)c2)n1.Cc1cc(C)n(-c2cccc(Oc3ccc4c5ccccc5n(-c5cc(C(C)(C)C)ccn5)c4c3)c2)n1.[Pt+2].

What is the InChIKey of 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)?

The InChIKey is MRHXJNDKVVDKHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H30N4O.C32H30N4O.C23H19N3O.C9H12BrN.C4H9N.O.2Pt/c1-21-17-24(33(4,5)6)18-32(34-21)36-30-13-8-7-12-28(30)29-15-14-27(20-31(29)36)38-26-11-9-10-25(19-26)37-23(3)16-22(2)35-37;1-21-17-22(2)36(34-21)24-9-8-10-25(19-24)37-26-13-14-28-27-11-6-7-12-29(27)35(30(28)20-26)31-18-23(15-16-33-31)32(3,4)5;1-15-12-16(2)26(25-15)17-6-5-7-18(13-17)27-19-10-11-21-20-8-3-4-9-22(20)24-23(21)14-19;1-9(2,3)7-4-5-11-8(10)6-7;1-4(2,3)5;;;/h7-18H,1-6H3;6-20H,1-5H3;3-14,24H,1-2H3;4-6H,1-3H3;1-3H3;;;/q-2;;;;;;;+2.

What are the key properties of 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+)?

2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+) has a molecular weight of 2030.06 g/mol, XLogP of 26.50, 11 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-4-tert-butylpyridine;tert-butylimino(oxo)platinum;9-(4-tert-butyl-6-methyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazole;2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]-9H-carbazole;platinum(2+) is sourced from PubChem (CID 157392472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).