[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium

C55H43F4GeIrN3O-2 — CID 167355906

IUPAC[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium
SMILESFc1cccc2nc(-c3[c-]ccc4c3oc3ccc(C(F)(F)F)cc34)n(-c3cc(-c4ccccc4)ccc3-c3ccccc3)c12.[2H]C(C)(C)c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.[Ir]
InChIInChI=1S/C38H21F4N2O.C17H22GeN.Ir/c39-31-15-8-16-32-35(31)44(33-21-25(23-9-3-1-4-10-23)17-19-27(33)24-11-5-2-6-12-24)37(43-32)29-14-7-13-28-30-22-26(38(40,41)42)18-20-34(30)45-36(28)29;1-13(2)15-11-17(14-9-7-6-8-10-14)19-12-16(15)18(3,4)5;/h1-13,15-22H;6-9,11-13H,1-5H3;/q2*-1;/i;13D;
InChIKeyFQKWXQUSUFEPIB-LTBAMTPYSA-N
MW1103.79 g/mol
LogP15.10
Rot. Bonds7

About [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium

[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium (PubChem CID 167355906) has the molecular formula C55H43F4GeIrN3O-2 and a molecular weight of 1103.79 g/mol. Its IUPAC name is [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium.

Molecular Properties

Compound Name[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium
PubChem CID167355906
Molecular FormulaC55H43F4GeIrN3O-2
Molecular Weight1103.79 g/mol
Exact Mass1105.23
IUPAC Name[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium
SMILESFc1cccc2nc(-c3[c-]ccc4c3oc3ccc(C(F)(F)F)cc34)n(-c3cc(-c4ccccc4)ccc3-c3ccccc3)c12.[2H]C(C)(C)c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.[Ir]
InChIInChI=1S/C38H21F4N2O.C17H22GeN.Ir/c39-31-15-8-16-32-35(31)44(33-21-25(23-9-3-1-4-10-23)17-19-27(33)24-11-5-2-6-12-24)37(43-32)29-14-7-13-28-30-22-26(38(40,41)42)18-20-34(30)45-36(28)29;1-13(2)15-11-17(14-9-7-6-8-10-14)19-12-16(15)18(3,4)5;/h1-13,15-22H;6-9,11-13H,1-5H3;/q2*-1;/i;13D;
InChIKeyFQKWXQUSUFEPIB-LTBAMTPYSA-N
XLogP15.10
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001103.79
LogP ≤ 515.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[3-(4-methoxyphenyl)-1-[6-(methylamino)pyrimidin-4-yl]indol-6-yl]phenyl]-3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)benzamide
CID 50992089
5-[[4-(1-Benzofuran-2-yl)phenyl]methyl]-2-(2,3-difluorophenyl)imidazo[4,5-c]pyridine
CID 59130543
7-(8-carbazol-9-yldibenzofuran-2-yl)-12H-imidazo[1,2-f]phenanthridin-12-ide;(Z)-1,1,1,5,5,5-hexafluoro-4-hydroxy-3-[4-(2-methylbutoxy)phenyl]pent-3-en-2-one;iridium
CID 59358466
7-(8-carbazol-9-yldibenzofuran-2-yl)-12H-imidazo[1,2-f]phenanthridin-12-ide;(Z)-1,1,1,5,5,5-hexafluoro-4-hydroxy-3-[4-(2-methylbutoxy)phenyl]pent-3-en-2-one;platinum
CID 59359359
[(3S)-3-[[2-[4-(1-benzofuran-5-yl)phenyl]-7-(trifluoromethyl)benzimidazol-1-yl]methyl]pyrrolidin-1-yl]-cyclopropylmethanone
CID 66579556
[(3R)-3-[[2-[4-(1-benzofuran-5-yl)phenyl]-7-(trifluoromethyl)benzimidazol-1-yl]methyl]pyrrolidin-1-yl]-cyclopropylmethanone
CID 66579557
[(3S)-3-[[2-[4-(1-benzofuran-5-yl)phenyl]-4-(trifluoromethyl)benzimidazol-1-yl]methyl]pyrrolidin-1-yl]-cyclopropylmethanone
CID 66579885
[(3R)-3-[[2-[4-(1-benzofuran-5-yl)phenyl]-4-(trifluoromethyl)benzimidazol-1-yl]methyl]pyrrolidin-1-yl]-cyclopropylmethanone
CID 66579886
5-[1-Biphenyl-4-ylmethyl-4,6-difluoro-5-(1-methyl-1H-indol-5-yl)-1H-benzoimidazol-2-yloxy]-2-methyl-benzoic acid methyl ester
CID 68573967
[3-[[2-[4-(1-Benzofuran-5-yl)phenyl]-7-(trifluoromethyl)benzimidazol-1-yl]methyl]pyrrolidin-1-yl]-cyclopropylmethanone
CID 77147541
[3-[[2-[4-(1-Benzofuran-5-yl)phenyl]-4-(trifluoromethyl)benzimidazol-1-yl]methyl]pyrrolidin-1-yl]-cyclopropylmethanone
CID 77147633
3-[9-[4,6-Bis(8-fluorodibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 121276711

Frequently Asked Questions

What is the IUPAC name of [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium?
The IUPAC name of [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium (CID 167355906) is [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium.
What is the SMILES notation for [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium?
The canonical SMILES for [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium is Fc1cccc2nc(-c3[c-]ccc4c3oc3ccc(C(F)(F)F)cc34)n(-c3cc(-c4ccccc4)ccc3-c3ccccc3)c12.[2H]C(C)(C)c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.[Ir].
What is the InChIKey of [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium?
The InChIKey is FQKWXQUSUFEPIB-LTBAMTPYSA-N. The full InChI is InChI=1S/C38H21F4N2O.C17H22GeN.Ir/c39-31-15-8-16-32-35(31)44(33-21-25(23-9-3-1-4-10-23)17-19-27(33)24-11-5-2-6-12-24)37(43-32)29-14-7-13-28-30-22-26(38(40,41)42)18-20-34(30)45-36(28)29;1-13(2)15-11-17(14-9-7-6-8-10-14)19-12-16(15)18(3,4)5;/h1-13,15-22H;6-9,11-13H,1-5H3;/q2*-1;/i;13D;.
What are the key properties of [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium?
[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium has a molecular weight of 1103.79 g/mol, XLogP of 15.10, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-(trifluoromethyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium is sourced from PubChem (CID 167355906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).