2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole

C150H102N8 — CID 158254689

IUPAC2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)C(c1ccc(-c2nc(-c4ccccc4)cc(-c4ccccc4)n2)cc1)c1ccccc1-3.c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)cc1.c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-n4c5ccccc5c5cc6c(cc54)C(c4ccccc4)(c4ccccc4)c4ccccc4-6)n3)c2)cc1
InChIInChI=1S/2C53H35N3.C44H32N2/c1-6-18-36(19-7-1)39-30-31-50-44(32-39)45-33-43-42-28-16-17-29-46(42)53(40-24-12-4-13-25-40,41-26-14-5-15-27-41)47(43)34-51(45)56(50)52-54-48(37-20-8-2-9-21-37)35-49(55-52)38-22-10-3-11-23-38;1-5-18-36(19-6-1)38-22-17-23-39(32-38)49-35-48(37-20-7-2-8-21-37)54-52(55-49)56-50-31-16-14-29-43(50)45-33-44-42-28-13-15-30-46(42)53(47(44)34-51(45)56,40-24-9-3-10-25-40)41-26-11-4-12-27-41;1-44(2)38-20-12-11-18-33(38)36-25-35-32-17-9-10-19-34(32)42(37(35)26-39(36)44)30-21-23-31(24-22-30)43-45-40(28-13-5-3-6-14-28)27-41(46-43)29-15-7-4-8-16-29/h2*1-35H;3-27,42H,1-2H3
InChIKeyGHDFTVQGNMMNOS-UHFFFAOYSA-N
MW2016.52 g/mol
LogP36.82
Rot. Bonds16

About 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole

2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole (PubChem CID 158254689) has the molecular formula C150H102N8 and a molecular weight of 2016.52 g/mol. Its IUPAC name is 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole.

Molecular Properties

Compound Name2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole
PubChem CID158254689
Molecular FormulaC150H102N8
Molecular Weight2016.52 g/mol
Exact Mass2014.82
IUPAC Name2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)C(c1ccc(-c2nc(-c4ccccc4)cc(-c4ccccc4)n2)cc1)c1ccccc1-3.c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)cc1.c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-n4c5ccccc5c5cc6c(cc54)C(c4ccccc4)(c4ccccc4)c4ccccc4-6)n3)c2)cc1
InChIInChI=1S/2C53H35N3.C44H32N2/c1-6-18-36(19-7-1)39-30-31-50-44(32-39)45-33-43-42-28-16-17-29-46(42)53(40-24-12-4-13-25-40,41-26-14-5-15-27-41)47(43)34-51(45)56(50)52-54-48(37-20-8-2-9-21-37)35-49(55-52)38-22-10-3-11-23-38;1-5-18-36(19-6-1)38-22-17-23-39(32-38)49-35-48(37-20-7-2-8-21-37)54-52(55-49)56-50-31-16-14-29-43(50)45-33-44-42-28-13-15-30-46(42)53(47(44)34-51(45)56,40-24-9-3-10-25-40)41-26-11-4-12-27-41;1-44(2)38-20-12-11-18-33(38)36-25-35-32-17-9-10-19-34(32)42(37(35)26-39(36)44)30-21-23-31(24-22-30)43-45-40(28-13-5-3-6-14-28)27-41(46-43)29-15-7-4-8-16-29/h2*1-35H;3-27,42H,1-2H3
InChIKeyGHDFTVQGNMMNOS-UHFFFAOYSA-N
XLogP36.82
TPSA87.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms158
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002016.52
LogP ≤ 536.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole with MolForge

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Related Compounds

5-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]-7,7-dimethyl-2-phenylindeno[2,1-b]carbazole;5-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-7,7-dimethyl-2-phenylindeno[2,1-b]carbazole
CID 159343293
7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[2,1-b]carbazole;7,7-diphenyl-5-(3-phenylquinoxalin-2-yl)indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-7,7-diphenyl-3-(9-phenylfluoren-9-yl)indeno[2,1-b]carbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole
CID 160927766
5-[4-[3-(3,5-diphenylphenyl)phenyl]-6-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]pyrimidin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 134237084
5-[4-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-6-phenylpyrimidin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 121465317
7,7-dimethyl-2-(9-phenylcarbazol-3-yl)-5-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indeno[2,1-b]carbazole
CID 130209432
2,4-bis[3-(3,5-diphenylphenyl)phenyl]-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine;5-[4,6-bis[3-(3,5-diphenylphenyl)phenyl]-1,3,5-triazin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;9-[2-[4,6-bis[3-(3,5-diphenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9,9'-spirobi[fluorene]-2'-yl]-3-[3-(3,5-diphenylphenyl)phenyl]carbazole
CID 158897511
5-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;methane
CID 160846132
5-(4,6-diphenylpyrimidin-2-yl)-7,7-dimethyl-2-(9-phenylcarbazol-2-yl)indeno[2,1-b]carbazole
CID 90226957
11,11-diphenyl-5-[2-phenyl-6-(11-phenyl-11H-indeno[1,2-b]carbazol-5-yl)pyrimidin-4-yl]indeno[1,2-b]carbazole
CID 123343063
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 87159836
3-[9-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]carbazol-3-yl]-9-(9,9-dimethylfluoren-2-yl)-6-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]carbazole;9-(9,9-dimethylfluoren-2-yl)-3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-6-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]carbazole
CID 160991667
9-[4-carbazol-9-yl-6-[4-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-1,3,5-triazin-2-yl]-2-phenylcarbazole
CID 168742539

Frequently Asked Questions

What is the IUPAC name of 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole?
The IUPAC name of 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole (CID 158254689) is 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole.
What is the SMILES notation for 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole?
The canonical SMILES for 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole is CC1(C)c2ccccc2-c2cc3c(cc21)C(c1ccc(-c2nc(-c4ccccc4)cc(-c4ccccc4)n2)cc1)c1ccccc1-3.c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)cc1.c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-n4c5ccccc5c5cc6c(cc54)C(c4ccccc4)(c4ccccc4)c4ccccc4-6)n3)c2)cc1.
What is the InChIKey of 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole?
The InChIKey is GHDFTVQGNMMNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C53H35N3.C44H32N2/c1-6-18-36(19-7-1)39-30-31-50-44(32-39)45-33-43-42-28-16-17-29-46(42)53(40-24-12-4-13-25-40,41-26-14-5-15-27-41)47(43)34-51(45)56(50)52-54-48(37-20-8-2-9-21-37)35-49(55-52)38-22-10-3-11-23-38;1-5-18-36(19-6-1)38-22-17-23-39(32-38)49-35-48(37-20-7-2-8-21-37)54-52(55-49)56-50-31-16-14-29-43(50)45-33-44-42-28-13-15-30-46(42)53(47(44)34-51(45)56,40-24-9-3-10-25-40)41-26-11-4-12-27-41;1-44(2)38-20-12-11-18-33(38)36-25-35-32-17-9-10-19-34(32)42(37(35)26-39(36)44)30-21-23-31(24-22-30)43-45-40(28-13-5-3-6-14-28)27-41(46-43)29-15-7-4-8-16-29/h2*1-35H;3-27,42H,1-2H3.
What are the key properties of 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole?
2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole has a molecular weight of 2016.52 g/mol, XLogP of 36.82, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(10,10-dimethyl-12H-indeno[2,3-b]fluoren-12-yl)phenyl]-4,6-diphenylpyrimidine;7,7-diphenyl-5-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]indeno[2,1-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-2,7,7-triphenylindeno[2,1-b]carbazole is sourced from PubChem (CID 158254689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).