9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole

C82H56N6 — CID 144536448

IUPAC9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole
SMILESCC1C=C(c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3c(c2)-c2cc(-n4c5ccc(-c6ccccc6-c6ccccn6)cc5c5cc(-c6ccccc6-c6ccccn6)ccc54)ccc2C3)C(c2ccccn2)=CC1
InChIInChI=1S/C82H56N6/c1-52-26-35-67(78-25-11-15-43-86-78)68(44-52)58-32-39-82-74(49-58)73-48-57(63-18-4-7-21-66(63)77-24-10-14-42-85-77)31-38-81(73)88(82)60-34-28-54-45-53-27-33-59(50-69(53)70(54)51-60)87-79-36-29-55(61-16-2-5-19-64(61)75-22-8-12-40-83-75)46-71(79)72-47-56(30-37-80(72)87)62-17-3-6-20-65(62)76-23-9-13-41-84-76/h2-25,27-44,46-52H,26,45H2,1H3
InChIKeyFGTGSUYCYAJALH-UHFFFAOYSA-N
MW1125.39 g/mol
LogP20.54
Rot. Bonds10

About 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole

9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole (PubChem CID 144536448) has the molecular formula C82H56N6 and a molecular weight of 1125.39 g/mol. Its IUPAC name is 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole.

Molecular Properties

Compound Name9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole
PubChem CID144536448
Molecular FormulaC82H56N6
Molecular Weight1125.39 g/mol
Exact Mass1124.46
IUPAC Name9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole
SMILESCC1C=C(c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3c(c2)-c2cc(-n4c5ccc(-c6ccccc6-c6ccccn6)cc5c5cc(-c6ccccc6-c6ccccn6)ccc54)ccc2C3)C(c2ccccn2)=CC1
InChIInChI=1S/C82H56N6/c1-52-26-35-67(78-25-11-15-43-86-78)68(44-52)58-32-39-82-74(49-58)73-48-57(63-18-4-7-21-66(63)77-24-10-14-42-85-77)31-38-81(73)88(82)60-34-28-54-45-53-27-33-59(50-69(53)70(54)51-60)87-79-36-29-55(61-16-2-5-19-64(61)75-22-8-12-40-83-75)46-71(79)72-47-56(30-37-80(72)87)62-17-3-6-20-65(62)76-23-9-13-41-84-76/h2-25,27-44,46-52H,26,45H2,1H3
InChIKeyFGTGSUYCYAJALH-UHFFFAOYSA-N
XLogP20.54
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms88
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001125.39
LogP ≤ 520.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole with MolForge

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Related Compounds

8-(2-pyridin-2-ylphenyl)-5-[6-[8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-9H-fluoren-3-yl]pyrido[3,2-b]indole
CID 129259902
8-(2-phenylphenyl)-5-[6-[8-(2-phenylphenyl)pyrido[3,2-b]indol-5-yl]-9H-fluoren-3-yl]pyrido[3,2-b]indole
CID 163641051
3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridin-2-ylphenyl]carbazole
CID 138578511
3-(2-pyridin-2-ylphenyl)-9-[7-[3-(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-3-yl]carbazole
CID 123136164
3-[6-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-methylcyclohexa-1,5-dien-1-yl]-9-phenylcarbazole
CID 139302548
5-[3-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]phenyl]-8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indole;ethene
CID 144612501
5-(9-methylcarbazol-3-yl)-8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indole
CID 58370085
9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine
CID 144536431
9-(8-cyclohexa-2,4-dien-1-yl-6,7-dihydrodibenzothiophen-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole
CID 144627584
3,6-bis(2-pyridin-2-ylphenyl)-9-[8-[3-(2-pyridin-2-ylphenyl)-9H-fluoren-9-yl]dibenzothiophen-2-yl]carbazole
CID 118069043
3-(4-ethenylphenyl)-9-[8-[3-(4-ethenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-6-(2-pyridin-2-ylphenyl)carbazole
CID 88853124
3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridin-2-ylphenyl]carbazole
CID 138578689

Frequently Asked Questions

What is the IUPAC name of 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole?
The IUPAC name of 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole (CID 144536448) is 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole.
What is the SMILES notation for 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole?
The canonical SMILES for 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole is CC1C=C(c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3c(c2)-c2cc(-n4c5ccc(-c6ccccc6-c6ccccn6)cc5c5cc(-c6ccccc6-c6ccccn6)ccc54)ccc2C3)C(c2ccccn2)=CC1.
What is the InChIKey of 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole?
The InChIKey is FGTGSUYCYAJALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C82H56N6/c1-52-26-35-67(78-25-11-15-43-86-78)68(44-52)58-32-39-82-74(49-58)73-48-57(63-18-4-7-21-66(63)77-24-10-14-42-85-77)31-38-81(73)88(82)60-34-28-54-45-53-27-33-59(50-69(53)70(54)51-60)87-79-36-29-55(61-16-2-5-19-64(61)75-22-8-12-40-83-75)46-71(79)72-47-56(30-37-80(72)87)62-17-3-6-20-65(62)76-23-9-13-41-84-76/h2-25,27-44,46-52H,26,45H2,1H3.
What are the key properties of 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole?
9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole has a molecular weight of 1125.39 g/mol, XLogP of 20.54, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-9H-fluoren-3-yl]-3-(3-methyl-6-pyridin-2-ylcyclohexa-1,5-dien-1-yl)-6-(2-pyridin-2-ylphenyl)carbazole is sourced from PubChem (CID 144536448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).