3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine

C219H134N10S5 — CID 162248039

IUPAC3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine
SMILESCC1(C)c2cc(-c3ccc4sc5ccccc5c4c3)ccc2-c2ccc(-c3cnc4c5ccccc5c5ccccc5c4n3)cc21.Cc1cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c(C)cc1-c1ccc2sc3ccccc3c2c1.c1cc(-c2ccc3sc4ccccc4c3c2)cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c1.c1ccc(C2(c3ccccc3)c3cc(-c4ccc5sc6ccccc6c5c4)ccc3-c3ccc(-c4cnc5c6ccccc6c6ccccc6c5n4)cc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2cc(-c3ccc4sc5ccccc5c4c3)ccc2-c2ccc(-c3cnc4c5ccccc5c5ccccc5c4n3)cc21
InChIInChI=1S/C53H30N2S.C53H32N2S.C43H28N2S.C36H24N2S.C34H20N2S/c1-3-16-41-34(11-1)35-12-2-4-17-42(35)52-51(41)54-30-48(55-52)33-22-25-39-38-24-21-32(31-23-26-50-43(27-31)40-15-7-10-20-49(40)56-50)28-46(38)53(47(39)29-33)44-18-8-5-13-36(44)37-14-6-9-19-45(37)53;1-3-13-36(14-4-1)53(37-15-5-2-6-16-37)46-30-34(33-25-28-50-45(29-33)42-19-11-12-22-49(42)56-50)23-26-40(46)41-27-24-35(31-47(41)53)48-32-54-51-43-20-9-7-17-38(43)39-18-8-10-21-44(39)52(51)55-48;1-43(2)36-22-26(25-17-20-40-35(21-25)32-11-7-8-14-39(32)46-40)15-18-30(36)31-19-16-27(23-37(31)43)38-24-44-41-33-12-5-3-9-28(33)29-10-4-6-13-34(29)42(41)45-38;1-21-18-30(22(2)17-29(21)23-15-16-34-31(19-23)26-11-7-8-14-33(26)39-34)32-20-37-35-27-12-5-3-9-24(27)25-10-4-6-13-28(25)36(35)38-32;1-3-13-27-24(10-1)25-11-2-4-14-28(25)34-33(27)35-20-30(36-34)23-9-7-8-21(18-23)22-16-17-32-29(19-22)26-12-5-6-15-31(26)37-32/h1-30H;1-32H;3-24H,1-2H3;3-20H,1-2H3;1-20H
InChIKeyZXPNGIJJFKPVDE-UHFFFAOYSA-N
MW3065.89 g/mol
LogP59.82
Rot. Bonds12

About 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine

3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine (PubChem CID 162248039) has the molecular formula C219H134N10S5 and a molecular weight of 3065.89 g/mol. Its IUPAC name is 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine.

Molecular Properties

Compound Name3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine
PubChem CID162248039
Molecular FormulaC219H134N10S5
Molecular Weight3065.89 g/mol
Exact Mass3062.94
IUPAC Name3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine
SMILESCC1(C)c2cc(-c3ccc4sc5ccccc5c4c3)ccc2-c2ccc(-c3cnc4c5ccccc5c5ccccc5c4n3)cc21.Cc1cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c(C)cc1-c1ccc2sc3ccccc3c2c1.c1cc(-c2ccc3sc4ccccc4c3c2)cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c1.c1ccc(C2(c3ccccc3)c3cc(-c4ccc5sc6ccccc6c5c4)ccc3-c3ccc(-c4cnc5c6ccccc6c6ccccc6c5n4)cc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2cc(-c3ccc4sc5ccccc5c4c3)ccc2-c2ccc(-c3cnc4c5ccccc5c5ccccc5c4n3)cc21
InChIInChI=1S/C53H30N2S.C53H32N2S.C43H28N2S.C36H24N2S.C34H20N2S/c1-3-16-41-34(11-1)35-12-2-4-17-42(35)52-51(41)54-30-48(55-52)33-22-25-39-38-24-21-32(31-23-26-50-43(27-31)40-15-7-10-20-49(40)56-50)28-46(38)53(47(39)29-33)44-18-8-5-13-36(44)37-14-6-9-19-45(37)53;1-3-13-36(14-4-1)53(37-15-5-2-6-16-37)46-30-34(33-25-28-50-45(29-33)42-19-11-12-22-49(42)56-50)23-26-40(46)41-27-24-35(31-47(41)53)48-32-54-51-43-20-9-7-17-38(43)39-18-8-10-21-44(39)52(51)55-48;1-43(2)36-22-26(25-17-20-40-35(21-25)32-11-7-8-14-39(32)46-40)15-18-30(36)31-19-16-27(23-37(31)43)38-24-44-41-33-12-5-3-9-28(33)29-10-4-6-13-34(29)42(41)45-38;1-21-18-30(22(2)17-29(21)23-15-16-34-31(19-23)26-11-7-8-14-33(26)39-34)32-20-37-35-27-12-5-3-9-24(27)25-10-4-6-13-28(25)36(35)38-32;1-3-13-27-24(10-1)25-11-2-4-14-28(25)34-33(27)35-20-30(36-34)23-9-7-8-21(18-23)22-16-17-32-29(19-22)26-12-5-6-15-31(26)37-32/h1-30H;1-32H;3-24H,1-2H3;3-20H,1-2H3;1-20H
InChIKeyZXPNGIJJFKPVDE-UHFFFAOYSA-N
XLogP59.82
TPSA128.90 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds12
Heavy Atoms234
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003065.89
LogP ≤ 559.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine with MolForge

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Related Compounds

3-[4-[4-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063218
3-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[3-[9,9-dimethyl-7-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)fluoren-2-yl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 158509894
3-(7-dibenzothiophen-4-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine
CID 58410378
3-[7-(3-dibenzothiophen-2-ylphenyl)-9-ethyl-9-methylfluoren-2-yl]phenanthro[9,10-b]pyrazine
CID 129075586
3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine
CID 58410043
4-[3-(2-dibenzothiophen-2-ylphenyl)phenyl]-6-(9,9-diphenylfluoren-2-yl)-2-phenylpyrimidine
CID 171601971
4-[2-(3-dibenzothiophen-2-ylphenyl)phenyl]-6-(9,9-diphenylfluoren-2-yl)-2-phenylpyrimidine
CID 171602842
4-(2-dibenzothiophen-2-ylphenyl)-6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171603972
3-(3-dibenzothiophen-2-ylphenyl)-7,10-diphenylphenanthro[9,10-b]pyrazine
CID 58410093
3-(5-dibenzothiophen-2-ylnaphthalen-1-yl)phenanthro[9,10-b]pyrazine
CID 58410390
4-[3,5-di(dibenzothiophen-4-yl)phenyl]dibenzothiophene;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;N,4-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;3-[3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 158490369
4-[3-dibenzothiophen-2-yl-5-(3-phenylphenyl)phenyl]-6-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171585075

Frequently Asked Questions

What is the IUPAC name of 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine?
The IUPAC name of 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine (CID 162248039) is 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine.
What is the SMILES notation for 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine?
The canonical SMILES for 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine is CC1(C)c2cc(-c3ccc4sc5ccccc5c4c3)ccc2-c2ccc(-c3cnc4c5ccccc5c5ccccc5c4n3)cc21.Cc1cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c(C)cc1-c1ccc2sc3ccccc3c2c1.c1cc(-c2ccc3sc4ccccc4c3c2)cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c1.c1ccc(C2(c3ccccc3)c3cc(-c4ccc5sc6ccccc6c5c4)ccc3-c3ccc(-c4cnc5c6ccccc6c6ccccc6c5n4)cc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2cc(-c3ccc4sc5ccccc5c4c3)ccc2-c2ccc(-c3cnc4c5ccccc5c5ccccc5c4n3)cc21.
What is the InChIKey of 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine?
The InChIKey is ZXPNGIJJFKPVDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H30N2S.C53H32N2S.C43H28N2S.C36H24N2S.C34H20N2S/c1-3-16-41-34(11-1)35-12-2-4-17-42(35)52-51(41)54-30-48(55-52)33-22-25-39-38-24-21-32(31-23-26-50-43(27-31)40-15-7-10-20-49(40)56-50)28-46(38)53(47(39)29-33)44-18-8-5-13-36(44)37-14-6-9-19-45(37)53;1-3-13-36(14-4-1)53(37-15-5-2-6-16-37)46-30-34(33-25-28-50-45(29-33)42-19-11-12-22-49(42)56-50)23-26-40(46)41-27-24-35(31-47(41)53)48-32-54-51-43-20-9-7-17-38(43)39-18-8-10-21-44(39)52(51)55-48;1-43(2)36-22-26(25-17-20-40-35(21-25)32-11-7-8-14-39(32)46-40)15-18-30(36)31-19-16-27(23-37(31)43)38-24-44-41-33-12-5-3-9-28(33)29-10-4-6-13-34(29)42(41)45-38;1-21-18-30(22(2)17-29(21)23-15-16-34-31(19-23)26-11-7-8-14-33(26)39-34)32-20-37-35-27-12-5-3-9-24(27)25-10-4-6-13-28(25)36(35)38-32;1-3-13-27-24(10-1)25-11-2-4-14-28(25)34-33(27)35-20-30(36-34)23-9-7-8-21(18-23)22-16-17-32-29(19-22)26-12-5-6-15-31(26)37-32/h1-30H;1-32H;3-24H,1-2H3;3-20H,1-2H3;1-20H.
What are the key properties of 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine?
3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine has a molecular weight of 3065.89 g/mol, XLogP of 59.82, 12 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-dibenzothiophen-2-yl-9,9-dimethylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(4-dibenzothiophen-2-yl-2,5-dimethylphenyl)phenanthro[9,10-b]pyrazine;3-(7-dibenzothiophen-2-yl-9,9-diphenylfluoren-2-yl)phenanthro[9,10-b]pyrazine;3-(3-dibenzothiophen-2-ylphenyl)phenanthro[9,10-b]pyrazine;3-(7'-dibenzothiophen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenanthro[9,10-b]pyrazine is sourced from PubChem (CID 162248039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).