[6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)

C187H184Ir5N10S5Si5-10 — CID 157050374

IUPAC[6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)
SMILESCC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1c[c-]c(-c2cc(C3CC3)ccn2)c2sc3ccccc3c12.C[Si](C)(C)c1ccc2c(c1)sc1c(-c3cc(C4CC4)ccn3)[c-]ccc12.C[Si](C)(C)c1ccc2sc3c(-c4cc(C5CC5)ccn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1sc1c(-c3cc(C4CCCC4)ccn3)[c-]ccc12.C[Si](C)(C)c1cccc2sc3c(-c4cc(C5CC5)ccn4)[c-]ccc3c12.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C25H26NSSi.4C23H22NSSi.5C14H14N.5Ir/c1-28(2,3)23-13-7-11-20-19-10-6-12-21(24(19)27-25(20)23)22-16-18(14-15-26-22)17-8-4-5-9-17;1-26(2,3)21-9-5-8-20-22(21)18-7-4-6-17(23(18)25-20)19-14-16(12-13-24-19)15-10-11-15;1-26(2,3)17-9-10-18-19-5-4-6-20(23(19)25-22(18)14-17)21-13-16(11-12-24-21)15-7-8-15;1-26(2,3)17-9-10-22-20(14-17)18-5-4-6-19(23(18)25-22)21-13-16(11-12-24-21)15-7-8-15;1-26(2,3)21-11-10-17(19-14-16(12-13-24-19)15-8-9-15)23-22(21)18-6-4-5-7-20(18)25-23;5*1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;;;;;/h6-7,10-11,13-17H,4-5,8-9H2,1-3H3;4-5,7-9,12-15H,10-11H2,1-3H3;2*4-5,9-15H,7-8H2,1-3H3;4-7,11-15H,8-9H2,1-3H3;5*3-6,8-11H,1-2H3;;;;;/q10*-1;;;;;
InChIKeySSRPSKHYGXKOOW-UHFFFAOYSA-N
MW3833.45 g/mol
LogP50.83
Rot. Bonds25

About [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)

[6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine) (PubChem CID 157050374) has the molecular formula C187H184Ir5N10S5Si5-10 and a molecular weight of 3833.45 g/mol. Its IUPAC name is [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine).

Molecular Properties

Compound Name[6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)
PubChem CID157050374
Molecular FormulaC187H184Ir5N10S5Si5-10
Molecular Weight3833.45 g/mol
Exact Mass3834.04
IUPAC Name[6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)
SMILESCC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1c[c-]c(-c2cc(C3CC3)ccn2)c2sc3ccccc3c12.C[Si](C)(C)c1ccc2c(c1)sc1c(-c3cc(C4CC4)ccn3)[c-]ccc12.C[Si](C)(C)c1ccc2sc3c(-c4cc(C5CC5)ccn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1sc1c(-c3cc(C4CCCC4)ccn3)[c-]ccc12.C[Si](C)(C)c1cccc2sc3c(-c4cc(C5CC5)ccn4)[c-]ccc3c12.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C25H26NSSi.4C23H22NSSi.5C14H14N.5Ir/c1-28(2,3)23-13-7-11-20-19-10-6-12-21(24(19)27-25(20)23)22-16-18(14-15-26-22)17-8-4-5-9-17;1-26(2,3)21-9-5-8-20-22(21)18-7-4-6-17(23(18)25-20)19-14-16(12-13-24-19)15-10-11-15;1-26(2,3)17-9-10-18-19-5-4-6-20(23(19)25-22(18)14-17)21-13-16(11-12-24-21)15-7-8-15;1-26(2,3)17-9-10-22-20(14-17)18-5-4-6-19(23(18)25-22)21-13-16(11-12-24-21)15-7-8-15;1-26(2,3)21-11-10-17(19-14-16(12-13-24-19)15-8-9-15)23-22(21)18-6-4-5-7-20(18)25-23;5*1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;;;;;/h6-7,10-11,13-17H,4-5,8-9H2,1-3H3;4-5,7-9,12-15H,10-11H2,1-3H3;2*4-5,9-15H,7-8H2,1-3H3;4-7,11-15H,8-9H2,1-3H3;5*3-6,8-11H,1-2H3;;;;;/q10*-1;;;;;
InChIKeySSRPSKHYGXKOOW-UHFFFAOYSA-N
XLogP50.83
TPSA128.90 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds25
Heavy Atoms212
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003833.45
LogP ≤ 550.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine) with MolForge

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Related Compounds

2-(2H-dibenzothiophen-2-id-3-yl)-5-methylpyridine;iridium(3+);bis(2-methyl-6-phenylpyridine)
CID 59500153
2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;iridium(3+);bis(2-methyl-6-phenylpyridine)
CID 59500182
2-(3H-dibenzothiophen-3-id-2-yl)-5-methylpyridine;iridium(3+);bis(2-methyl-6-phenylpyridine)
CID 59500237
2-(2H-dibenzothiophen-2-id-3-yl)-4-methylpyridine;iridium(3+);bis(2-methyl-6-phenylpyridine)
CID 59500248
5-[9,9,10,10,24,24,25,25-Octamethyl-13,21,28-tris(pyrido[4,3-b]indol-5-yl)-2,17-dithia-9,10,24,25-tetrasilaheptacyclo[24.4.0.03,8.04,30.011,16.015,19.018,23]triaconta-1(30),3,5,7,11,13,15,18,20,22,26,28-dodecaen-6-yl]pyrido[4,3-b]indole
CID 140731847
(1-Dibenzothiophen-4-yl-[1]benzothiolo[2,3-c]pyridin-8-yl)-(8-dibenzothiophen-4-yl-[1]benzothiolo[2,3-c]pyridin-1-yl)-diphenylsilane
CID 140811467
Bis[6-([1]benzothiolo[2,3-c]pyridin-1-yl)dibenzothiophen-4-yl]-diphenylsilane
CID 140811497
Bis[6-([1]benzothiolo[2,3-c]pyridin-3-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]-diphenylsilane
CID 140811558
Bis[6-([1]benzothiolo[2,3-c]pyridin-1-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]-diphenylsilane
CID 140811560
[8-([1]Benzothiolo[2,3-c]pyridin-1-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]-(8-dibenzothiophen-4-yl-[1]benzothiolo[2,3-c]pyridin-1-yl)-diphenylsilane
CID 140811568
[8-([1]Benzothiolo[2,3-c]pyridin-1-yl)-[1]benzothiolo[2,3-c]pyridin-1-yl]-[6-([1]benzothiolo[2,3-c]pyridin-1-yl)dibenzothiophen-4-yl]-diphenylsilane
CID 140811635
(4-Cyclopentyl-6-phenyl-3-pyridinyl)-trimethylsilane;5-dibenzothiophen-4-yl-2-phenylpyridine;iridium
CID 153501080

Frequently Asked Questions

What is the IUPAC name of [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)?
The IUPAC name of [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine) (CID 157050374) is [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine).
What is the SMILES notation for [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)?
The canonical SMILES for [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine) is CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.CC(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1c[c-]c(-c2cc(C3CC3)ccn2)c2sc3ccccc3c12.C[Si](C)(C)c1ccc2c(c1)sc1c(-c3cc(C4CC4)ccn3)[c-]ccc12.C[Si](C)(C)c1ccc2sc3c(-c4cc(C5CC5)ccn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1sc1c(-c3cc(C4CCCC4)ccn3)[c-]ccc12.C[Si](C)(C)c1cccc2sc3c(-c4cc(C5CC5)ccn4)[c-]ccc3c12.[Ir].[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)?
The InChIKey is SSRPSKHYGXKOOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26NSSi.4C23H22NSSi.5C14H14N.5Ir/c1-28(2,3)23-13-7-11-20-19-10-6-12-21(24(19)27-25(20)23)22-16-18(14-15-26-22)17-8-4-5-9-17;1-26(2,3)21-9-5-8-20-22(21)18-7-4-6-17(23(18)25-20)19-14-16(12-13-24-19)15-10-11-15;1-26(2,3)17-9-10-18-19-5-4-6-20(23(19)25-22(18)14-17)21-13-16(11-12-24-21)15-7-8-15;1-26(2,3)17-9-10-22-20(14-17)18-5-4-6-19(23(18)25-22)21-13-16(11-12-24-21)15-7-8-15;1-26(2,3)21-11-10-17(19-14-16(12-13-24-19)15-8-9-15)23-22(21)18-6-4-5-7-20(18)25-23;5*1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;;;;;/h6-7,10-11,13-17H,4-5,8-9H2,1-3H3;4-5,7-9,12-15H,10-11H2,1-3H3;2*4-5,9-15H,7-8H2,1-3H3;4-7,11-15H,8-9H2,1-3H3;5*3-6,8-11H,1-2H3;;;;;/q10*-1;;;;;.
What are the key properties of [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine)?
[6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine) has a molecular weight of 3833.45 g/mol, XLogP of 50.83, 25 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-cyclopentyl-2-pyridinyl)-7H-dibenzothiophen-7-id-4-yl]-trimethylsilane;[4-(4-cyclopropyl-2-pyridinyl)-3H-dibenzothiophen-3-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-1-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-2-yl]-trimethylsilane;[6-(4-cyclopropyl-2-pyridinyl)-7H-dibenzothiophen-7-id-3-yl]-trimethylsilane;pentakis(iridium);pentakis(2-phenyl-5-propan-2-ylpyridine) is sourced from PubChem (CID 157050374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).