2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol

C44H36N4OSi — CID 140865435

IUPAC2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol
SMILESC[Si](C)(C)c1cnc(-c2cc(-c3ccccc3)cc(-c3cccc4c3nc(-c3ncccc3O)n4-c3ccccc3)c2)cc1-c1ccccc1
InChIInChI=1S/C44H36N4OSi/c1-50(2,3)41-29-46-38(28-37(41)31-17-9-5-10-18-31)34-26-32(30-15-7-4-8-16-30)25-33(27-34)36-21-13-22-39-42(36)47-44(43-40(49)23-14-24-45-43)48(39)35-19-11-6-12-20-35/h4-29,49H,1-3H3
InChIKeyGCWWFXNRMAHLJS-UHFFFAOYSA-N
MW664.89 g/mol
LogP10.40
Rot. Bonds7

About 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol

2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol (PubChem CID 140865435) has the molecular formula C44H36N4OSi and a molecular weight of 664.89 g/mol. Its IUPAC name is 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol.

Molecular Properties

Compound Name2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol
PubChem CID140865435
Molecular FormulaC44H36N4OSi
Molecular Weight664.89 g/mol
Exact Mass664.27
IUPAC Name2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol
SMILESC[Si](C)(C)c1cnc(-c2cc(-c3ccccc3)cc(-c3cccc4c3nc(-c3ncccc3O)n4-c3ccccc3)c2)cc1-c1ccccc1
InChIInChI=1S/C44H36N4OSi/c1-50(2,3)41-29-46-38(28-37(41)31-17-9-5-10-18-31)34-26-32(30-15-7-4-8-16-30)25-33(27-34)36-21-13-22-39-42(36)47-44(43-40(49)23-14-24-45-43)48(39)35-19-11-6-12-20-35/h4-29,49H,1-3H3
InChIKeyGCWWFXNRMAHLJS-UHFFFAOYSA-N
XLogP10.40
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500664.89
LogP ≤ 510.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol with MolForge

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Launch Full Analysis

Related Compounds

2-[1-phenyl-4-[3-phenyl-5-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]benzimidazol-2-yl]pyridin-3-ol
CID 140864165
4,6-ditert-butyl-2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol
CID 140864477
3-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-2-ol
CID 140865175
6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol
CID 140864229
2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]phenol
CID 140832113
4-[4-[3-tert-butyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]-1-methylbenzimidazol-2-yl]pyridin-3-ol
CID 140865089
2-[1-phenyl-4-[3-phenyl-5-[5-(1-phenylethyl)-2-pyridinyl]phenyl]benzimidazol-2-yl]phenol
CID 164742379
5-tert-butyl-3-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-2-ol
CID 140865377
2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaen-14-yl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]phenol
CID 162783397
2-[1-phenyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)phenyl]imidazo[4,5-c]pyridin-2-yl]phenol
CID 140864345
2-[4-[3-(3,5-ditert-butylphenyl)-5-(5-trimethylsilyl-2-pyridinyl)phenyl]-1-phenylbenzimidazol-2-yl]phenol
CID 140833081
4,6-ditert-butyl-2-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol
CID 140864359

Frequently Asked Questions

What is the IUPAC name of 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol?
The IUPAC name of 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol (CID 140865435) is 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol.
What is the SMILES notation for 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol?
The canonical SMILES for 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol is C[Si](C)(C)c1cnc(-c2cc(-c3ccccc3)cc(-c3cccc4c3nc(-c3ncccc3O)n4-c3ccccc3)c2)cc1-c1ccccc1.
What is the InChIKey of 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol?
The InChIKey is GCWWFXNRMAHLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H36N4OSi/c1-50(2,3)41-29-46-38(28-37(41)31-17-9-5-10-18-31)34-26-32(30-15-7-4-8-16-30)25-33(27-34)36-21-13-22-39-42(36)47-44(43-40(49)23-14-24-45-43)48(39)35-19-11-6-12-20-35/h4-29,49H,1-3H3.
What are the key properties of 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol?
2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol has a molecular weight of 664.89 g/mol, XLogP of 10.40, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol is sourced from PubChem (CID 140865435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).