5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]

C145H92N10 — CID 159099157

IUPAC5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5c(c6ccccc64)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)nc4ccccc34)cc21.c1ccc(-c2cc(-n3c4c(c5ccccc53)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5c(c6ccccc64)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c3)nc(-c3cccc4ccccc34)n2)cc1
InChIInChI=1S/C52H32N4.C50H33N3.C43H27N3/c1-2-17-34(18-3-1)49-53-50(55-51(54-49)40-27-15-19-33-16-4-5-22-37(33)40)35-20-14-21-36(32-35)56-46-31-13-9-26-42(46)47-48(56)41-25-8-12-30-45(41)52(47)43-28-10-6-23-38(43)39-24-7-11-29-44(39)52;1-49(2)38-21-9-3-15-31(38)34-28-27-30(29-42(34)49)46-36-19-7-13-25-43(36)51-48(52-46)53-44-26-14-8-20-37(44)45-47(53)35-18-6-12-24-41(35)50(45)39-22-10-4-16-32(39)33-17-5-11-23-40(33)50;1-3-15-28(16-4-1)37-27-39(45-42(44-37)29-17-5-2-6-18-29)46-38-26-14-10-22-33(38)40-41(46)32-21-9-13-25-36(32)43(40)34-23-11-7-19-30(34)31-20-8-12-24-35(31)43/h1-32H;3-29H,1-2H3;1-27H
InChIKeyKDBCHHSMPLNKKB-UHFFFAOYSA-N
MW1974.40 g/mol
LogP34.30
Rot. Bonds9

About 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]

5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole] (PubChem CID 159099157) has the molecular formula C145H92N10 and a molecular weight of 1974.40 g/mol. Its IUPAC name is 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole].

Molecular Properties

Compound Name5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]
PubChem CID159099157
Molecular FormulaC145H92N10
Molecular Weight1974.40 g/mol
Exact Mass1972.75
IUPAC Name5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5c(c6ccccc64)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)nc4ccccc34)cc21.c1ccc(-c2cc(-n3c4c(c5ccccc53)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5c(c6ccccc64)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c3)nc(-c3cccc4ccccc34)n2)cc1
InChIInChI=1S/C52H32N4.C50H33N3.C43H27N3/c1-2-17-34(18-3-1)49-53-50(55-51(54-49)40-27-15-19-33-16-4-5-22-37(33)40)35-20-14-21-36(32-35)56-46-31-13-9-26-42(46)47-48(56)41-25-8-12-30-45(41)52(47)43-28-10-6-23-38(43)39-24-7-11-29-44(39)52;1-49(2)38-21-9-3-15-31(38)34-28-27-30(29-42(34)49)46-36-19-7-13-25-43(36)51-48(52-46)53-44-26-14-8-20-37(44)45-47(53)35-18-6-12-24-41(35)50(45)39-22-10-4-16-32(39)33-17-5-11-23-40(33)50;1-3-15-28(16-4-1)37-27-39(45-42(44-37)29-17-5-2-6-18-29)46-38-26-14-10-22-33(38)40-41(46)32-21-9-13-25-36(32)43(40)34-23-11-7-19-30(34)31-20-8-12-24-35(31)43/h1-32H;3-29H,1-2H3;1-27H
InChIKeyKDBCHHSMPLNKKB-UHFFFAOYSA-N
XLogP34.30
TPSA105.02 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds9
Heavy Atoms155
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001974.40
LogP ≤ 534.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole] with MolForge

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Related Compounds

7,7-dimethyl-5-[3-[4-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenyl]indeno[2,1-b]carbazole
CID 139567879
5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-7,7-dimethyl-2-phenanthridin-6-ylindeno[2,1-b]carbazole
CID 121337578
23-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-23-azahexacyclo[12.7.1.13,21.02,7.08,13.018,22]tricosa-1(21),2(7),3,5,8,10,12,14,16,18(22),19-undecaene
CID 157051523
5-[11-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[a]carbazol-5-yl]-11-phenylbenzo[a]carbazole;5-[11-(4-naphthalen-1-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-11-phenylbenzo[a]carbazole;5-(11-phenylbenzo[a]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole
CID 159898026
5-[3-[4-carbazol-9-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 169014140
2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9-(4-phenylquinazolin-2-yl)carbazole
CID 129312343
12-(9,9-dimethylfluoren-2-yl)-16-(4-phenylquinazolin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene;16-(4-naphthalen-1-ylquinazolin-2-yl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene;16-(4-naphthalen-2-ylquinazolin-2-yl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene
CID 158538438
11-(9,9-dimethylfluoren-2-yl)-12-(2,6-diphenyl-4-pyridinyl)indolo[2,3-a]carbazole;11-(9,9-dimethylfluoren-2-yl)-12-(2,6-diphenylpyrimidin-4-yl)indolo[2,3-a]carbazole;11-(9,9-dimethylfluoren-2-yl)-12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazole;11-(9,9-dimethylfluoren-2-yl)-12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[2,3-a]carbazole;methane
CID 158616372
5-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-3-yl)benzo[b]carbazole
CID 146874125
9-[3-[4-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]phenyl]carbazole
CID 144649974
9-[3-[3-[4-(9,9-dimethylfluoren-2-yl)-6-phenylpyrimidin-2-yl]phenyl]phenyl]carbazole
CID 67678509
3-(9,9-dimethylfluoren-2-yl)-9-[3-[4-[3-(9,9-dimethylfluoren-2-yl)carbazol-9-yl]-6-(2,5-diphenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 134236850

Frequently Asked Questions

What is the IUPAC name of 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]?
The IUPAC name of 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole] (CID 159099157) is 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole].
What is the SMILES notation for 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]?
The canonical SMILES for 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole] is CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5c(c6ccccc64)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)nc4ccccc34)cc21.c1ccc(-c2cc(-n3c4c(c5ccccc53)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5c(c6ccccc64)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c3)nc(-c3cccc4ccccc34)n2)cc1.
What is the InChIKey of 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]?
The InChIKey is KDBCHHSMPLNKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N4.C50H33N3.C43H27N3/c1-2-17-34(18-3-1)49-53-50(55-51(54-49)40-27-15-19-33-16-4-5-22-37(33)40)35-20-14-21-36(32-35)56-46-31-13-9-26-42(46)47-48(56)41-25-8-12-30-45(41)52(47)43-28-10-6-23-38(43)39-24-7-11-29-44(39)52;1-49(2)38-21-9-3-15-31(38)34-28-27-30(29-42(34)49)46-36-19-7-13-25-43(36)51-48(52-46)53-44-26-14-8-20-37(44)45-47(53)35-18-6-12-24-41(35)50(45)39-22-10-4-16-32(39)33-17-5-11-23-40(33)50;1-3-15-28(16-4-1)37-27-39(45-42(44-37)29-17-5-2-6-18-29)46-38-26-14-10-22-33(38)40-41(46)32-21-9-13-25-36(32)43(40)34-23-11-7-19-30(34)31-20-8-12-24-35(31)43/h1-32H;3-29H,1-2H3;1-27H.
What are the key properties of 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole]?
5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole] has a molecular weight of 1974.40 g/mol, XLogP of 34.30, 9 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,10'-indeno[1,2-b]indole];5'-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,10'-indeno[1,2-b]indole] is sourced from PubChem (CID 159099157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).