4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine

C192H136N6 — CID 158383269

IUPAC4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)-c3c(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3C43c4ccccc4C(C)(C)c4ccccc43)cc21.CC1(C)c2ccccc2C2(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3-c3c(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)cccc32)c2ccccc21.CC1(C)c2ccccc2C2(c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3-c3c(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)cccc32)c2ccccc21
InChIInChI=1S/C69H48N2.C64H44N2.C59H44N2/c1-67(2)57-33-17-19-35-59(57)69(60-36-20-18-34-58(60)67)56-41-39-47(48-38-40-52-51-30-15-16-32-55(51)68(62(52)43-48,49-26-11-5-12-27-49)50-28-13-6-14-29-50)42-54(56)65-53(31-21-37-61(65)69)64-44-63(45-22-7-3-8-23-45)70-66(71-64)46-24-9-4-10-25-46;1-63(2)52-32-16-18-34-54(52)64(55-35-19-17-33-53(55)63)51-38-37-44(60-47-29-14-12-27-45(47)59(42-23-8-4-9-24-42)46-28-13-15-30-48(46)60)39-50(51)61-49(31-20-36-56(61)64)58-40-57(41-21-6-3-7-22-41)65-62(66-58)43-25-10-5-11-26-43;1-57(2)45-24-12-11-22-41(45)42-32-30-40(35-52(42)57)39-31-33-46-44(34-39)55-43(54-36-53(37-18-7-5-8-19-37)60-56(61-54)38-20-9-6-10-21-38)23-17-29-51(55)59(46)49-27-15-13-25-47(49)58(3,4)48-26-14-16-28-50(48)59/h3-44H,1-2H3;3-40H,1-2H3;5-36H,1-4H3
InChIKeyGWBBTYCGFWUXGR-UHFFFAOYSA-N
MW2527.24 g/mol
LogP47.08
Rot. Bonds15

About 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine

4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine (PubChem CID 158383269) has the molecular formula C192H136N6 and a molecular weight of 2527.24 g/mol. Its IUPAC name is 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine.

Molecular Properties

Compound Name4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine
PubChem CID158383269
Molecular FormulaC192H136N6
Molecular Weight2527.24 g/mol
Exact Mass2525.08
IUPAC Name4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)-c3c(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3C43c4ccccc4C(C)(C)c4ccccc43)cc21.CC1(C)c2ccccc2C2(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3-c3c(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)cccc32)c2ccccc21.CC1(C)c2ccccc2C2(c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3-c3c(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)cccc32)c2ccccc21
InChIInChI=1S/C69H48N2.C64H44N2.C59H44N2/c1-67(2)57-33-17-19-35-59(57)69(60-36-20-18-34-58(60)67)56-41-39-47(48-38-40-52-51-30-15-16-32-55(51)68(62(52)43-48,49-26-11-5-12-27-49)50-28-13-6-14-29-50)42-54(56)65-53(31-21-37-61(65)69)64-44-63(45-22-7-3-8-23-45)70-66(71-64)46-24-9-4-10-25-46;1-63(2)52-32-16-18-34-54(52)64(55-35-19-17-33-53(55)63)51-38-37-44(60-47-29-14-12-27-45(47)59(42-23-8-4-9-24-42)46-28-13-15-30-48(46)60)39-50(51)61-49(31-20-36-56(61)64)58-40-57(41-21-6-3-7-22-41)65-62(66-58)43-25-10-5-11-26-43;1-57(2)45-24-12-11-22-41(45)42-32-30-40(35-52(42)57)39-31-33-46-44(34-39)55-43(54-36-53(37-18-7-5-8-19-37)60-56(61-54)38-20-9-6-10-21-38)23-17-29-51(55)59(46)49-27-15-13-25-47(49)58(3,4)48-26-14-16-28-50(48)59/h3-44H,1-2H3;3-40H,1-2H3;5-36H,1-4H3
InChIKeyGWBBTYCGFWUXGR-UHFFFAOYSA-N
XLogP47.08
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms198
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002527.24
LogP ≤ 547.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-(9,9-dimethylfluoren-3-yl)naphthalen-1-yl]-6-(9,9-diphenylfluoren-4-yl)-2-phenylpyrimidine
CID 168777603
4-(9,9-dimethylfluoren-2-yl)-6-[4-[3-(9,9-diphenylfluoren-3-yl)phenyl]naphthalen-1-yl]-2-phenylpyrimidine
CID 168779038
4-[4-(9,9-dimethylfluoren-4-yl)naphthalen-1-yl]-6-(9,9-diphenylfluoren-4-yl)-2-phenylpyrimidine
CID 168777628
4-(9,9-dimethylfluoren-3-yl)-6-[4-(9,9-diphenylfluoren-3-yl)naphthalen-1-yl]-2-phenylpyrimidine
CID 176834778
4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyridine
CID 142480534
4-(11,11-dimethylbenzo[b]fluoren-4-yl)-2-phenyl-6-[4-(9,9'-spirobi[fluorene]-3-yl)naphthalen-1-yl]pyrimidine
CID 176793365
2-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl)phenyl]-4,6-diphenylpyrimidine;2-[4-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-3'-yl)phenyl]phenyl]-4,6-diphenylpyrimidine;4-[3-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2'-yl)phenyl]phenyl]-2,6-diphenylpyrimidine
CID 158046858
4-(11,11-dimethylbenzo[b]fluoren-4-yl)-2-phenyl-6-[6-(9,9'-spirobi[fluorene]-2-yl)naphthalen-2-yl]pyrimidine
CID 176793263
2-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-4,6-diphenylpyridine;4-[3-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[3-(9,9-diphenylfluoren-2-yl)phenyl]-4,6-diphenylpyrimidine;2-[4-(9,9-diphenylfluoren-2-yl)phenyl]-4,6-diphenylpyrimidine;4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2,6-diphenylpyrimidine;4-[4-(9,9-diphenylfluoren-2-yl)phenyl]-2,6-diphenylpyrimidine
CID 163695786
4-[2-(11,11-dimethylbenzo[b]fluoren-4-yl)phenyl]-6-[2-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 176794472
4-[3-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2'-yl)phenyl]-2-phenyl-6-(4-phenylnaphthalen-1-yl)pyrimidine
CID 146495349
4-[4-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl)naphthalen-1-yl]phenyl]-2,6-diphenylpyrimidine
CID 153302478

Frequently Asked Questions

What is the IUPAC name of 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine?
The IUPAC name of 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine (CID 158383269) is 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine.
What is the SMILES notation for 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine?
The canonical SMILES for 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine is CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)-c3c(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3C43c4ccccc4C(C)(C)c4ccccc43)cc21.CC1(C)c2ccccc2C2(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3-c3c(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)cccc32)c2ccccc21.CC1(C)c2ccccc2C2(c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3-c3c(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)cccc32)c2ccccc21.
What is the InChIKey of 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine?
The InChIKey is GWBBTYCGFWUXGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H48N2.C64H44N2.C59H44N2/c1-67(2)57-33-17-19-35-59(57)69(60-36-20-18-34-58(60)67)56-41-39-47(48-38-40-52-51-30-15-16-32-55(51)68(62(52)43-48,49-26-11-5-12-27-49)50-28-13-6-14-29-50)42-54(56)65-53(31-21-37-61(65)69)64-44-63(45-22-7-3-8-23-45)70-66(71-64)46-24-9-4-10-25-46;1-63(2)52-32-16-18-34-54(52)64(55-35-19-17-33-53(55)63)51-38-37-44(60-47-29-14-12-27-45(47)59(42-23-8-4-9-24-42)46-28-13-15-30-48(46)60)39-50(51)61-49(31-20-36-56(61)64)58-40-57(41-21-6-3-7-22-41)65-62(66-58)43-25-10-5-11-26-43;1-57(2)45-24-12-11-22-41(45)42-32-30-40(35-52(42)57)39-31-33-46-44(34-39)55-43(54-36-53(37-18-7-5-8-19-37)60-56(61-54)38-20-9-6-10-21-38)23-17-29-51(55)59(46)49-27-15-13-25-47(49)58(3,4)48-26-14-16-28-50(48)59/h3-44H,1-2H3;3-40H,1-2H3;5-36H,1-4H3.
What are the key properties of 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine?
4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine has a molecular weight of 2527.24 g/mol, XLogP of 47.08, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6'-(9,9-dimethylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[9,9-dimethyl-6'-(10-phenylanthracen-9-yl)spiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine;4-[6'-(9,9-diphenylfluoren-2-yl)-9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl]-2,6-diphenylpyrimidine is sourced from PubChem (CID 158383269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).