2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine

C166H124N6O4 — CID 153448961

IUPAC2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine
SMILESCC(C)(C)c1ccnc(-c2ccc(-c3ccccc3-c3cc(-c4ccccc4-c4ccc(-c5ccc(-c6ccccc6-c6cc(-c7ccccc7-c7ccc(-c8cc(C(C)(C)C)ccn8)cc7-c7cccc8oc9ccccc9c78)cc(-c7ccccc7-c7ccc(-c8cc(C(C)(C)C)ccn8)cc7-c7cccc8oc9ccccc9c78)c6)cn5)nc4)cc(-c4ccccc4-c4ccc(-c5cc(C(C)(C)C)ccn5)cc4-c4cccc5oc6ccccc6c45)c3)c(-c3cccc4oc5ccccc5c34)c2)c1
InChIInChI=1S/C166H124N6O4/c1-163(2,3)113-77-81-167-147(95-113)101-65-71-129(141(91-101)133-53-33-61-155-159(133)137-49-25-29-57-151(137)173-155)125-45-21-17-41-121(125)109-85-107(86-110(89-109)122-42-18-22-46-126(122)130-72-66-102(148-96-114(78-82-168-148)164(4,5)6)92-142(130)134-54-34-62-156-160(134)138-50-26-30-58-152(138)174-156)119-39-15-13-37-117(119)105-69-75-145(171-99-105)146-76-70-106(100-172-146)118-38-14-16-40-120(118)108-87-111(123-43-19-23-47-127(123)131-73-67-103(149-97-115(79-83-169-149)165(7,8)9)93-143(131)135-55-35-63-157-161(135)139-51-27-31-59-153(139)175-157)90-112(88-108)124-44-20-24-48-128(124)132-74-68-104(150-98-116(80-84-170-150)166(10,11)12)94-144(132)136-56-36-64-158-162(136)140-52-28-32-60-154(140)176-158/h13-100H,1-12H3
InChIKeyWIRGELFIABOQOC-UHFFFAOYSA-N
MW2266.86 g/mol
LogP45.85
Rot. Bonds21

About 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine

2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine (PubChem CID 153448961) has the molecular formula C166H124N6O4 and a molecular weight of 2266.86 g/mol. Its IUPAC name is 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine.

Molecular Properties

Compound Name2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine
PubChem CID153448961
Molecular FormulaC166H124N6O4
Molecular Weight2266.86 g/mol
Exact Mass2264.97
IUPAC Name2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine
SMILESCC(C)(C)c1ccnc(-c2ccc(-c3ccccc3-c3cc(-c4ccccc4-c4ccc(-c5ccc(-c6ccccc6-c6cc(-c7ccccc7-c7ccc(-c8cc(C(C)(C)C)ccn8)cc7-c7cccc8oc9ccccc9c78)cc(-c7ccccc7-c7ccc(-c8cc(C(C)(C)C)ccn8)cc7-c7cccc8oc9ccccc9c78)c6)cn5)nc4)cc(-c4ccccc4-c4ccc(-c5cc(C(C)(C)C)ccn5)cc4-c4cccc5oc6ccccc6c45)c3)c(-c3cccc4oc5ccccc5c34)c2)c1
InChIInChI=1S/C166H124N6O4/c1-163(2,3)113-77-81-167-147(95-113)101-65-71-129(141(91-101)133-53-33-61-155-159(133)137-49-25-29-57-151(137)173-155)125-45-21-17-41-121(125)109-85-107(86-110(89-109)122-42-18-22-46-126(122)130-72-66-102(148-96-114(78-82-168-148)164(4,5)6)92-142(130)134-54-34-62-156-160(134)138-50-26-30-58-152(138)174-156)119-39-15-13-37-117(119)105-69-75-145(171-99-105)146-76-70-106(100-172-146)118-38-14-16-40-120(118)108-87-111(123-43-19-23-47-127(123)131-73-67-103(149-97-115(79-83-169-149)165(7,8)9)93-143(131)135-55-35-63-157-161(135)139-51-27-31-59-153(139)175-157)90-112(88-108)124-44-20-24-48-128(124)132-74-68-104(150-98-116(80-84-170-150)166(10,11)12)94-144(132)136-56-36-64-158-162(136)140-52-28-32-60-154(140)176-158/h13-100H,1-12H3
InChIKeyWIRGELFIABOQOC-UHFFFAOYSA-N
XLogP45.85
TPSA129.90 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds21
Heavy Atoms176
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002266.86
LogP ≤ 545.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine with MolForge

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Related Compounds

2-[4-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-(2,6-dimethylphenyl)phenyl]phenyl]phenyl]phenyl]-3-(2,6-dimethylphenyl)phenyl]-4-tert-butylpyridine
CID 140838950
2-[4-[2-[4-[2-[4-(4-tert-butyl-2-pyridinyl)-2-(3-dibenzofuran-4-ylphenyl)phenyl]phenyl]-2,3,5,6-tetramethylphenyl]phenyl]-3-(3-dibenzofuran-4-ylphenyl)phenyl]-4-methyl-5-phenylpyridine
CID 153295059
2-[4-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-4-ylbenzene-5-id-1-yl]phenyl]phenyl]phenyl]-3-dibenzofuran-4-ylbenzene-6-id-1-yl]-4-tert-butylpyridine;iridium(3+)
CID 140838377
19-(4-tert-butyl-2-pyridinyl)-10-oxa-15-azaheptacyclo[13.10.1.02,14.03,11.04,9.016,21.022,26]hexacosa-1(25),2(14),3(11),4,6,8,12,16(21),17,19,22(26),23-dodecaene
CID 164803201
4-(2-cyclopentylpropan-2-yl)-2-(9-phenyldibenzofuran-2-yl)pyridine
CID 166574902
4-tert-butyl-2-[6-(3,5-ditert-butylphenyl)dibenzofuran-3-yl]pyridine
CID 166575883
19-(4-tert-butyl-2-pyridinyl)-26-methyl-12-oxa-15-azahexacyclo[20.3.1.02,14.05,13.06,11.016,21]hexacosa-1(26),2(14),3,5(13),6,8,10,16(21),17,19,22,24-dodecaene
CID 168766413
2-[4-[2-[3-[2-[4-(4-tert-butyl-2-pyridinyl)-2-phenylphenyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine
CID 134226053
2-(1-bromodibenzofuran-4-yl)-4-tert-butylpyridine
CID 164796614
3-[4-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-3-(4-phenylphenyl)phenyl]-[1]benzofuro[3,2-c]pyridine
CID 153458209
2-[4-[2-[3,5-bis[2-[2-bromo-4-(4-tert-butyl-2-pyridinyl)phenyl]phenyl]phenyl]phenyl]-3-bromophenyl]-4-methyl-5-phenylpyridine
CID 140838831
4-tert-butyl-2-(7-phenyldibenzofuran-2-yl)pyridine
CID 155610550

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine?
The IUPAC name of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine (CID 153448961) is 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine.
What is the SMILES notation for 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine?
The canonical SMILES for 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine is CC(C)(C)c1ccnc(-c2ccc(-c3ccccc3-c3cc(-c4ccccc4-c4ccc(-c5ccc(-c6ccccc6-c6cc(-c7ccccc7-c7ccc(-c8cc(C(C)(C)C)ccn8)cc7-c7cccc8oc9ccccc9c78)cc(-c7ccccc7-c7ccc(-c8cc(C(C)(C)C)ccn8)cc7-c7cccc8oc9ccccc9c78)c6)cn5)nc4)cc(-c4ccccc4-c4ccc(-c5cc(C(C)(C)C)ccn5)cc4-c4cccc5oc6ccccc6c45)c3)c(-c3cccc4oc5ccccc5c34)c2)c1.
What is the InChIKey of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine?
The InChIKey is WIRGELFIABOQOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C166H124N6O4/c1-163(2,3)113-77-81-167-147(95-113)101-65-71-129(141(91-101)133-53-33-61-155-159(133)137-49-25-29-57-151(137)173-155)125-45-21-17-41-121(125)109-85-107(86-110(89-109)122-42-18-22-46-126(122)130-72-66-102(148-96-114(78-82-168-148)164(4,5)6)92-142(130)134-54-34-62-156-160(134)138-50-26-30-58-152(138)174-156)119-39-15-13-37-117(119)105-69-75-145(171-99-105)146-76-70-106(100-172-146)118-38-14-16-40-120(118)108-87-111(123-43-19-23-47-127(123)131-73-67-103(149-97-115(79-83-169-149)165(7,8)9)93-143(131)135-55-35-63-157-161(135)139-51-27-31-59-153(139)175-157)90-112(88-108)124-44-20-24-48-128(124)132-74-68-104(150-98-116(80-84-170-150)166(10,11)12)94-144(132)136-56-36-64-158-162(136)140-52-28-32-60-154(140)176-158/h13-100H,1-12H3.
What are the key properties of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine?
2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine has a molecular weight of 2266.86 g/mol, XLogP of 45.85, 21 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(4-tert-butyl-2-pyridinyl)-2-dibenzofuran-1-ylphenyl]phenyl]phenyl]phenyl]-3-dibenzofuran-1-ylphenyl]-4-tert-butylpyridine is sourced from PubChem (CID 153448961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).