2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol

C196H168N8O6 — CID 160559506

IUPAC2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol
SMILESCc1cc(C)c(-c2cc(-c3cccc(C4(c5ccccn5)c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)c3)nc(-c3ccccc3O)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3cccc(C4(c5ccccn5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccccc3O)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3ccccc3O)nc3c2ccc2ccc(C4(c5ccccn5)c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)cc23)c(C)c1.Cc1cc(C)c(-c2cc(-c3ccccc3O)nc3c2ccc2ccc(C4(c5ccccn5)c5ccccc5Oc5ccccc54)cc23)c(C)c1
InChIInChI=1S/C54H50N2O.C52H50N2O.C46H34N2O2.C44H34N2O2/c1-32-26-33(2)50(34(3)27-32)44-31-47(42-14-10-11-15-48(42)57)56-51-41(44)22-18-35-17-19-38(28-43(35)51)54(49-16-12-13-25-55-49)45-29-36(52(4,5)6)20-23-39(45)40-24-21-37(30-46(40)54)53(7,8)9;1-32-25-33(2)49(34(3)26-32)36-28-45(54-46(29-36)42-17-10-11-18-47(42)55)35-15-14-16-39(27-35)52(48-19-12-13-24-53-48)43-30-37(50(4,5)6)20-22-40(43)41-23-21-38(31-44(41)52)51(7,8)9;1-28-24-29(2)44(30(3)25-28)36-27-39(34-12-4-7-15-40(34)49)48-45-33(36)22-20-31-19-21-32(26-35(31)45)46(43-18-10-11-23-47-43)37-13-5-8-16-41(37)50-42-17-9-6-14-38(42)46;1-28-23-29(2)43(30(3)24-28)32-26-37(46-38(27-32)34-15-4-7-18-39(34)47)31-13-12-14-33(25-31)44(42-21-10-11-22-45-42)35-16-5-8-19-40(35)48-41-20-9-6-17-36(41)44/h10-31,57H,1-9H3;10-31,55H,1-9H3;4-27,49H,1-3H3;4-27,47H,1-3H3
InChIKeyQZCSNQGCFPWTER-UHFFFAOYSA-N
MW2731.55 g/mol
LogP48.61
Rot. Bonds18

About 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol

2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol (PubChem CID 160559506) has the molecular formula C196H168N8O6 and a molecular weight of 2731.55 g/mol. Its IUPAC name is 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol.

Molecular Properties

Compound Name2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol
PubChem CID160559506
Molecular FormulaC196H168N8O6
Molecular Weight2731.55 g/mol
Exact Mass2729.31
IUPAC Name2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol
SMILESCc1cc(C)c(-c2cc(-c3cccc(C4(c5ccccn5)c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)c3)nc(-c3ccccc3O)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3cccc(C4(c5ccccn5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccccc3O)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3ccccc3O)nc3c2ccc2ccc(C4(c5ccccn5)c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)cc23)c(C)c1.Cc1cc(C)c(-c2cc(-c3ccccc3O)nc3c2ccc2ccc(C4(c5ccccn5)c5ccccc5Oc5ccccc54)cc23)c(C)c1
InChIInChI=1S/C54H50N2O.C52H50N2O.C46H34N2O2.C44H34N2O2/c1-32-26-33(2)50(34(3)27-32)44-31-47(42-14-10-11-15-48(42)57)56-51-41(44)22-18-35-17-19-38(28-43(35)51)54(49-16-12-13-25-55-49)45-29-36(52(4,5)6)20-23-39(45)40-24-21-37(30-46(40)54)53(7,8)9;1-32-25-33(2)49(34(3)26-32)36-28-45(54-46(29-36)42-17-10-11-18-47(42)55)35-15-14-16-39(27-35)52(48-19-12-13-24-53-48)43-30-37(50(4,5)6)20-22-40(43)41-23-21-38(31-44(41)52)51(7,8)9;1-28-24-29(2)44(30(3)25-28)36-27-39(34-12-4-7-15-40(34)49)48-45-33(36)22-20-31-19-21-32(26-35(31)45)46(43-18-10-11-23-47-43)37-13-5-8-16-41(37)50-42-17-9-6-14-38(42)46;1-28-23-29(2)43(30(3)24-28)32-26-37(46-38(27-32)34-15-4-7-18-39(34)47)31-13-12-14-33(25-31)44(42-21-10-11-22-45-42)35-16-5-8-19-40(35)48-41-20-9-6-17-36(41)44/h10-31,57H,1-9H3;10-31,55H,1-9H3;4-27,49H,1-3H3;4-27,47H,1-3H3
InChIKeyQZCSNQGCFPWTER-UHFFFAOYSA-N
XLogP48.61
TPSA202.50 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds18
Heavy Atoms210
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002731.55
LogP ≤ 548.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol with MolForge

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Related Compounds

2-[6-[3-(9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol
CID 136997077
2-[3,5-ditert-butyl-6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-2-pyridinyl]phenol
CID 161415824
4-tert-butyl-2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)phenoxy]-5-(2,4,6-trimethylphenyl)phenyl]pyridine
CID 159029308
2-[6-[9-(3-benzo[g]quinoxalin-3-ylphenyl)-2,7-ditert-butylfluoren-9-yl]-2-pyridinyl]phenol
CID 166511841
2-[6-[2,7-ditert-butyl-9-[3-(7-cyclohexylfuro[3,2-d]pyrimidin-4-yl)phenyl]fluoren-9-yl]-2-pyridinyl]phenol
CID 166511816
2-[9-[3-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)phenoxy]phenyl]xanthen-9-yl]pyridine;1-[3-[3-(9-pyridin-2-ylxanthen-9-yl)phenoxy]-5-(2,4,6-trimethylphenyl)phenyl]isoquinoline;3-[3-[3-(9-pyridin-2-ylxanthen-9-yl)phenoxy]-5-(2,4,6-trimethylphenyl)phenyl]isoquinoline;2-[3-[3-(9-pyridin-2-ylxanthen-9-yl)phenoxy]-5-(2,4,6-trimethylphenyl)phenyl]quinoline
CID 157104232
2,7-ditert-butylspiro[fluorene-9,9'-xanthene]
CID 90153663
3-(3-carbazol-9-ylphenyl)-7,10-bis(4-phenylphenyl)phenanthro[9,10-b]pyrazine;3-(3-carbazol-9-ylphenyl)-7,10-bis(9,9'-spirobi[fluorene]-2-yl)phenanthro[9,10-b]pyrazine;3-(3-carbazol-9-ylphenyl)-7,10-bis(2,4,6-trimethylphenyl)phenanthro[9,10-b]pyrazine;3-(3-carbazol-9-ylphenyl)-7,10-dinaphthalen-1-ylphenanthro[9,10-b]pyrazine;3-(3-carbazol-9-ylphenyl)-7,10-diphenylphenanthro[9,10-b]pyrazine;7,10-ditert-butyl-3-(3-carbazol-9-ylphenyl)phenanthro[9,10-b]pyrazine
CID 157226450
2-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-9-[3-(1-methylimidazol-2-yl)phenyl]carbazole
CID 140716409
2'-[3-(8-methyl-7-phenylbenzo[c]fluoren-7-yl)phenyl]spiro[fluorene-9,9'-xanthene]
CID 170023891
9,9-bis(3-tert-butylphenyl)-2-methylfluorene;2',7'-ditert-butyl-2-methyl-9,9'-spirobi[fluorene];2-methylspiro[fluorene-9,9'-xanthene];2'-methylspiro[fluorene-9,9'-xanthene];4'-methylspiro[fluorene-9,9'-xanthene]
CID 163917294
4-tert-butyl-2-[1-(4-tert-butylphenyl)-6-naphthalen-1-yl-4-[3-[4-(2,4,6-trimethylphenyl)quinolin-8-yl]phenyl]benzimidazol-2-yl]phenol
CID 177110365

Frequently Asked Questions

What is the IUPAC name of 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol?
The IUPAC name of 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol (CID 160559506) is 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol.
What is the SMILES notation for 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol?
The canonical SMILES for 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol is Cc1cc(C)c(-c2cc(-c3cccc(C4(c5ccccn5)c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)c3)nc(-c3ccccc3O)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3cccc(C4(c5ccccn5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccccc3O)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3ccccc3O)nc3c2ccc2ccc(C4(c5ccccn5)c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)cc23)c(C)c1.Cc1cc(C)c(-c2cc(-c3ccccc3O)nc3c2ccc2ccc(C4(c5ccccn5)c5ccccc5Oc5ccccc54)cc23)c(C)c1.
What is the InChIKey of 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol?
The InChIKey is QZCSNQGCFPWTER-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H50N2O.C52H50N2O.C46H34N2O2.C44H34N2O2/c1-32-26-33(2)50(34(3)27-32)44-31-47(42-14-10-11-15-48(42)57)56-51-41(44)22-18-35-17-19-38(28-43(35)51)54(49-16-12-13-25-55-49)45-29-36(52(4,5)6)20-23-39(45)40-24-21-37(30-46(40)54)53(7,8)9;1-32-25-33(2)49(34(3)26-32)36-28-45(54-46(29-36)42-17-10-11-18-47(42)55)35-15-14-16-39(27-35)52(48-19-12-13-24-53-48)43-30-37(50(4,5)6)20-22-40(43)41-23-21-38(31-44(41)52)51(7,8)9;1-28-24-29(2)44(30(3)25-28)36-27-39(34-12-4-7-15-40(34)49)48-45-33(36)22-20-31-19-21-32(26-35(31)45)46(43-18-10-11-23-47-43)37-13-5-8-16-41(37)50-42-17-9-6-14-38(42)46;1-28-23-29(2)43(30(3)24-28)32-26-37(46-38(27-32)34-15-4-7-18-39(34)47)31-13-12-14-33(25-31)44(42-21-10-11-22-45-42)35-16-5-8-19-40(35)48-41-20-9-6-17-36(41)44/h10-31,57H,1-9H3;10-31,55H,1-9H3;4-27,49H,1-3H3;4-27,47H,1-3H3.
What are the key properties of 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol?
2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol has a molecular weight of 2731.55 g/mol, XLogP of 48.61, 18 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[3-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(2,7-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol;2-[6-[3-(9-pyridin-2-ylxanthen-9-yl)phenyl]-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol;2-[9-(9-pyridin-2-ylxanthen-9-yl)-4-(2,4,6-trimethylphenyl)benzo[h]quinolin-2-yl]phenol is sourced from PubChem (CID 160559506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).