2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline

C139H88N6O3 — CID 157220046

IUPAC2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccc6c(ccc7c8ccccc8oc67)c5)cc4)c4ccccc4n3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc(-c5ccc6c(ccc7c8ccccc8oc67)c5)cc4)c4ccccc4n3)c2)cc1.c1ccc2cc(-c3ccc(-c4nc(-c5ccc(-c6ccc7c(ccc8c9ccccc9oc78)c6)cc5)c5ccccc5n4)cc3)ccc2c1
InChIInChI=1S/C48H30N2O.C46H28N2O.C45H30N2O/c1-3-11-31(12-4-1)37-28-38(32-13-5-2-6-14-32)30-39(29-37)48-49-44-17-9-7-16-43(44)46(50-48)34-21-19-33(20-22-34)35-23-25-40-36(27-35)24-26-42-41-15-8-10-18-45(41)51-47(40)42;1-2-8-34-27-35(22-17-29(34)7-1)31-15-20-33(21-16-31)46-47-42-11-5-3-10-41(42)44(48-46)32-18-13-30(14-19-32)36-23-25-38-37(28-36)24-26-40-39-9-4-6-12-43(39)49-45(38)40;1-45(2)38-12-6-3-9-33(38)34-23-21-31(26-39(34)45)44-46-40-13-7-4-11-37(40)42(47-44)28-17-15-27(16-18-28)29-19-22-32-30(25-29)20-24-36-35-10-5-8-14-41(35)48-43(32)36/h1-30H;1-28H;3-26H,1-2H3
InChIKeyASWJWMIPNBLHIS-UHFFFAOYSA-N
MW1890.27 g/mol
LogP37.51
Rot. Bonds12

About 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline

2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline (PubChem CID 157220046) has the molecular formula C139H88N6O3 and a molecular weight of 1890.27 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline.

Molecular Properties

Compound Name2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline
PubChem CID157220046
Molecular FormulaC139H88N6O3
Molecular Weight1890.27 g/mol
Exact Mass1888.69
IUPAC Name2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccc6c(ccc7c8ccccc8oc67)c5)cc4)c4ccccc4n3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc(-c5ccc6c(ccc7c8ccccc8oc67)c5)cc4)c4ccccc4n3)c2)cc1.c1ccc2cc(-c3ccc(-c4nc(-c5ccc(-c6ccc7c(ccc8c9ccccc9oc78)c6)cc5)c5ccccc5n4)cc3)ccc2c1
InChIInChI=1S/C48H30N2O.C46H28N2O.C45H30N2O/c1-3-11-31(12-4-1)37-28-38(32-13-5-2-6-14-32)30-39(29-37)48-49-44-17-9-7-16-43(44)46(50-48)34-21-19-33(20-22-34)35-23-25-40-36(27-35)24-26-42-41-15-8-10-18-45(41)51-47(40)42;1-2-8-34-27-35(22-17-29(34)7-1)31-15-20-33(21-16-31)46-47-42-11-5-3-10-41(42)44(48-46)32-18-13-30(14-19-32)36-23-25-38-37(28-36)24-26-40-39-9-4-6-12-43(39)49-45(38)40;1-45(2)38-12-6-3-9-33(38)34-23-21-31(26-39(34)45)44-46-40-13-7-4-11-37(40)42(47-44)28-17-15-27(16-18-28)29-19-22-32-30(25-29)20-24-36-35-10-5-8-14-41(35)48-43(32)36/h1-30H;1-28H;3-26H,1-2H3
InChIKeyASWJWMIPNBLHIS-UHFFFAOYSA-N
XLogP37.51
TPSA116.76 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds12
Heavy Atoms148
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001890.27
LogP ≤ 537.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline with MolForge

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Related Compounds

4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)-2-[3-(4-phenylphenyl)phenyl]quinazoline;4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)-2-(4-phenylphenyl)quinazoline;4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)-2-phenylquinazoline
CID 158481385
4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)-2-[3-(4-phenylphenyl)phenyl]quinazoline
CID 155326605
2-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-4-(3-phenylphenyl)quinazoline;2-[4-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-4-phenylquinazoline
CID 167612820
4-(3-dibenzofuran-2-yl-5-naphthalen-2-ylphenyl)-6-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171582676
2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-2-ylphenyl)quinazoline
CID 155326671
4-(3-dibenzofuran-4-yl-5-phenylphenyl)-6-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171585086
2-[3-[4-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-4-yl]-4,6-diphenyl-1,3,5-triazine
CID 142491277
4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine
CID 160795004
2-dibenzofuran-4-yl-4-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 166025643
4-(9,9-dimethylfluoren-2-yl)-6-(3-naphtho[1,2-b][1]benzofuran-6-yl-5-phenylphenyl)-2-phenylpyrimidine
CID 171585610
2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-naphthalen-2-yl-6-[9-(3-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 170681105
4-dibenzofuran-3-yl-6-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-2-phenylpyrimidine;4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-naphthalen-1-yl-2-phenylpyrimidine;4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-naphthalen-2-yl-2-phenylpyrimidine
CID 159000045

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline?
The IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline (CID 157220046) is 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline.
What is the SMILES notation for 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline?
The canonical SMILES for 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline is CC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccc6c(ccc7c8ccccc8oc67)c5)cc4)c4ccccc4n3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc(-c5ccc6c(ccc7c8ccccc8oc67)c5)cc4)c4ccccc4n3)c2)cc1.c1ccc2cc(-c3ccc(-c4nc(-c5ccc(-c6ccc7c(ccc8c9ccccc9oc78)c6)cc5)c5ccccc5n4)cc3)ccc2c1.
What is the InChIKey of 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline?
The InChIKey is ASWJWMIPNBLHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O.C46H28N2O.C45H30N2O/c1-3-11-31(12-4-1)37-28-38(32-13-5-2-6-14-32)30-39(29-37)48-49-44-17-9-7-16-43(44)46(50-48)34-21-19-33(20-22-34)35-23-25-40-36(27-35)24-26-42-41-15-8-10-18-45(41)51-47(40)42;1-2-8-34-27-35(22-17-29(34)7-1)31-15-20-33(21-16-31)46-47-42-11-5-3-10-41(42)44(48-46)32-18-13-30(14-19-32)36-23-25-38-37(28-36)24-26-40-39-9-4-6-12-43(39)49-45(38)40;1-45(2)38-12-6-3-9-33(38)34-23-21-31(26-39(34)45)44-46-40-13-7-4-11-37(40)42(47-44)28-17-15-27(16-18-28)29-19-22-32-30(25-29)20-24-36-35-10-5-8-14-41(35)48-43(32)36/h1-30H;1-28H;3-26H,1-2H3.
What are the key properties of 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline?
2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline has a molecular weight of 1890.27 g/mol, XLogP of 37.51, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,9-dimethylfluoren-2-yl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(3,5-diphenylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline;2-(4-naphthalen-2-ylphenyl)-4-(4-naphtho[1,2-b][1]benzofuran-3-ylphenyl)quinazoline is sourced from PubChem (CID 157220046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).