10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane

C188H138N8O2S2Si2 — CID 160906604

IUPAC10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane
SMILESc1ccc(C2(c3ccccc3)c3ccccc3N(c3cccc(N4c5ccccc5C(c5ccccc5)(c5ccccc5)c5ccccc54)c3)c3ccccc32)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccccc3)c2)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(N2c3ccccc3Oc3ccccc32)cc1.c1ccc2c(c1)Sc1ccccc1N2c1ccc(N2c3ccccc3Sc3ccccc32)cc1
InChIInChI=1S/C56H40N2.C42H34Si2.C30H20N2O2.C30H20N2S2.C30H24N2/c1-5-22-41(23-6-1)55(42-24-7-2-8-25-42)47-32-13-17-36-51(47)57(52-37-18-14-33-48(52)55)45-30-21-31-46(40-45)58-53-38-19-15-34-49(53)56(43-26-9-3-10-27-43,44-28-11-4-12-29-44)50-35-16-20-39-54(50)58;1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)41-31-33-42(34-32-41)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40;2*1-5-13-27-23(9-1)31(24-10-2-6-14-28(24)33-27)21-17-19-22(20-18-21)32-25-11-3-7-15-29(25)34-30-16-8-4-12-26(30)32;1-5-14-25(15-6-1)31(26-16-7-2-8-17-26)29-22-13-23-30(24-29)32(27-18-9-3-10-19-27)28-20-11-4-12-21-28/h1-40H;1-34H;2*1-20H;1-24H
InChIKeySQFNQRTVIYOBFR-UHFFFAOYSA-N
MW2661.53 g/mol
LogP45.48
Rot. Bonds24

About 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane

10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane (PubChem CID 160906604) has the molecular formula C188H138N8O2S2Si2 and a molecular weight of 2661.53 g/mol. Its IUPAC name is 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane.

Molecular Properties

Compound Name10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane
PubChem CID160906604
Molecular FormulaC188H138N8O2S2Si2
Molecular Weight2661.53 g/mol
Exact Mass2658.99
IUPAC Name10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane
SMILESc1ccc(C2(c3ccccc3)c3ccccc3N(c3cccc(N4c5ccccc5C(c5ccccc5)(c5ccccc5)c5ccccc54)c3)c3ccccc32)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccccc3)c2)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(N2c3ccccc3Oc3ccccc32)cc1.c1ccc2c(c1)Sc1ccccc1N2c1ccc(N2c3ccccc3Sc3ccccc32)cc1
InChIInChI=1S/C56H40N2.C42H34Si2.C30H20N2O2.C30H20N2S2.C30H24N2/c1-5-22-41(23-6-1)55(42-24-7-2-8-25-42)47-32-13-17-36-51(47)57(52-37-18-14-33-48(52)55)45-30-21-31-46(40-45)58-53-38-19-15-34-49(53)56(43-26-9-3-10-27-43,44-28-11-4-12-29-44)50-35-16-20-39-54(50)58;1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)41-31-33-42(34-32-41)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40;2*1-5-13-27-23(9-1)31(24-10-2-6-14-28(24)33-27)21-17-19-22(20-18-21)32-25-11-3-7-15-29(25)34-30-16-8-4-12-26(30)32;1-5-14-25(15-6-1)31(26-16-7-2-8-17-26)29-22-13-23-30(24-29)32(27-18-9-3-10-19-27)28-20-11-4-12-21-28/h1-40H;1-34H;2*1-20H;1-24H
InChIKeySQFNQRTVIYOBFR-UHFFFAOYSA-N
XLogP45.48
TPSA44.38 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds24
Heavy Atoms202
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002661.53
LogP ≤ 545.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane?
The IUPAC name of 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane (CID 160906604) is 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane.
What is the SMILES notation for 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane?
The canonical SMILES for 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane is c1ccc(C2(c3ccccc3)c3ccccc3N(c3cccc(N4c5ccccc5C(c5ccccc5)(c5ccccc5)c5ccccc54)c3)c3ccccc32)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccccc3)c2)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(N2c3ccccc3Oc3ccccc32)cc1.c1ccc2c(c1)Sc1ccccc1N2c1ccc(N2c3ccccc3Sc3ccccc32)cc1.
What is the InChIKey of 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane?
The InChIKey is SQFNQRTVIYOBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H40N2.C42H34Si2.C30H20N2O2.C30H20N2S2.C30H24N2/c1-5-22-41(23-6-1)55(42-24-7-2-8-25-42)47-32-13-17-36-51(47)57(52-37-18-14-33-48(52)55)45-30-21-31-46(40-45)58-53-38-19-15-34-49(53)56(43-26-9-3-10-27-43,44-28-11-4-12-29-44)50-35-16-20-39-54(50)58;1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)41-31-33-42(34-32-41)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40;2*1-5-13-27-23(9-1)31(24-10-2-6-14-28(24)33-27)21-17-19-22(20-18-21)32-25-11-3-7-15-29(25)34-30-16-8-4-12-26(30)32;1-5-14-25(15-6-1)31(26-16-7-2-8-17-26)29-22-13-23-30(24-29)32(27-18-9-3-10-19-27)28-20-11-4-12-21-28/h1-40H;1-34H;2*1-20H;1-24H.
What are the key properties of 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane?
10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane has a molecular weight of 2661.53 g/mol, XLogP of 45.48, 24 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine;10-(4-phenothiazin-10-ylphenyl)phenothiazine;10-(4-phenoxazin-10-ylphenyl)phenoxazine;1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;triphenyl-(4-triphenylsilylphenyl)silane is sourced from PubChem (CID 160906604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).