2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum

C33H28N3OPtSi- — CID 140831945

IUPAC2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum
SMILESC[Si](C)(C)c1ccc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)ccc2)nc1.[Pt]
InChIInChI=1S/C33H28N3OSi.Pt/c1-38(2,3)26-19-20-29(34-22-26)24-12-9-11-23(21-24)27-16-10-17-30-32(27)35-33(28-15-7-8-18-31(28)37)36(30)25-13-5-4-6-14-25;/h4-20,22,37H,1-3H3;/q-1;
InChIKeyUVPBOCAYJUUANA-UHFFFAOYSA-N
MW705.77 g/mol
LogP7.47
Rot. Bonds5

About 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum

2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum (PubChem CID 140831945) has the molecular formula C33H28N3OPtSi- and a molecular weight of 705.77 g/mol. Its IUPAC name is 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum
PubChem CID140831945
Molecular FormulaC33H28N3OPtSi-
Molecular Weight705.77 g/mol
Exact Mass705.17
IUPAC Name2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum
SMILESC[Si](C)(C)c1ccc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)ccc2)nc1.[Pt]
InChIInChI=1S/C33H28N3OSi.Pt/c1-38(2,3)26-19-20-29(34-22-26)24-12-9-11-23(21-24)27-16-10-17-30-32(27)35-33(28-15-7-8-18-31(28)37)36(30)25-13-5-4-6-14-25;/h4-20,22,37H,1-3H3;/q-1;
InChIKeyUVPBOCAYJUUANA-UHFFFAOYSA-N
XLogP7.47
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500705.77
LogP ≤ 57.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-{6-Methyl-3-[(2-methylphenyl)amino]imidazo[1,2-a]pyridin-2-yl}phenol
CID 15989666
2-Methyl-4-[2-methyl-1-(1-methylpiperidin-4-yl)imidazo[4,5-c]quinolin-8-yl]phenol
CID 168274980
2-[2-Methyl-1-(1-methylpiperidin-4-yl)imidazo[4,5-c]quinolin-8-yl]phenol
CID 168284340
6-[[(6-Methyl-9-indolo[3,2-b]quinoxalinyl)amino]methylidene]-1-cyclohexa-2,4-dienone
CID 1547739
2-[[2-(2-Hydroxyphenyl)-4-(4-methylpiperazin-1-yl)imidazo[4,5-c]pyridin-1-yl]methyl]phenol
CID 145955961
4-(1-Phenyl-1h-imidazo[4,5-f][1,10]phenanthrolin-2-yl)phenol
CID 136703238
2-[3-[3-(Trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol;ZINC
CID 136066844
2-[1-(2-Ethyl-3-pyridinyl)imidazo[1,5-a]pyridin-3-yl]-4-fluorophenol
CID 155115191
2,4-Ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-(4-fluorophenyl)-5-(4-phenyl-2-pyridinyl)phenyl]benzimidazol-2-yl]phenol
CID 164518279
2,4-Ditert-butyl-6-[4-[3-tert-butyl-5-[4-(4-fluorophenyl)-2-pyridinyl]phenyl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol
CID 164518281
2,4-Ditert-butyl-6-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1-(trifluoromethyl)benzimidazol-2-yl]phenol;platinum
CID 164701419
2-[4-[3-[4-[4-[2,6-Bis(trifluoromethyl)phenyl]-2-tert-butylphenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4,6-ditert-butylphenol;platinum
CID 166496312

Frequently Asked Questions

What is the IUPAC name of 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The IUPAC name of 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum (CID 140831945) is 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum.
What is the SMILES notation for 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The canonical SMILES for 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum is C[Si](C)(C)c1ccc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)ccc2)nc1.[Pt].
What is the InChIKey of 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The InChIKey is UVPBOCAYJUUANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H28N3OSi.Pt/c1-38(2,3)26-19-20-29(34-22-26)24-12-9-11-23(21-24)27-16-10-17-30-32(27)35-33(28-15-7-8-18-31(28)37)36(30)25-13-5-4-6-14-25;/h4-20,22,37H,1-3H3;/q-1;.
What are the key properties of 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 705.77 g/mol, XLogP of 7.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-phenyl-4-[3-(5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 140831945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).