9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole

C60H37N3O — CID 58099699

IUPAC9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccccc32)c(-c2cccc3c2oc2c(-c4ccccc4-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)cc23)c1
InChIInChI=1S/C60H37N3O/c1-9-28-51-39(18-1)40-19-2-10-29-52(40)61(51)38-36-49(46-25-8-16-35-58(46)63-55-32-13-5-22-43(55)44-23-6-14-33-56(44)63)60-50(37-38)48-27-17-26-47(59(48)64-60)45-24-7-15-34-57(45)62-53-30-11-3-20-41(53)42-21-4-12-31-54(42)62/h1-37H
InChIKeyLNDZATKPZNAVRB-UHFFFAOYSA-N
MW815.98 g/mol
LogP16.21
Rot. Bonds5

About 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole

9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole (PubChem CID 58099699) has the molecular formula C60H37N3O and a molecular weight of 815.98 g/mol. Its IUPAC name is 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole.

Molecular Properties

Compound Name9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole
PubChem CID58099699
Molecular FormulaC60H37N3O
Molecular Weight815.98 g/mol
Exact Mass815.29
IUPAC Name9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccccc32)c(-c2cccc3c2oc2c(-c4ccccc4-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)cc23)c1
InChIInChI=1S/C60H37N3O/c1-9-28-51-39(18-1)40-19-2-10-29-52(40)61(51)38-36-49(46-25-8-16-35-58(46)63-55-32-13-5-22-43(55)44-23-6-14-33-56(44)63)60-50(37-38)48-27-17-26-47(59(48)64-60)45-24-7-15-34-57(45)62-53-30-11-3-20-41(53)42-21-4-12-31-54(42)62/h1-37H
InChIKeyLNDZATKPZNAVRB-UHFFFAOYSA-N
XLogP16.21
TPSA27.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500815.98
LogP ≤ 516.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-[18-(18-carbazol-9-yl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-8-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-8-yl]carbazole
CID 67952828
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
9-[2-(2-carbazol-9-yldibenzofuran-4-yl)phenyl]carbazole;[9-[2-(2-carbazol-9-ylphenyl)phenyl]carbazol-2-yl]-triphenylsilane;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]carbazole
CID 163832748
9-(6-carbazol-9-yldibenzofuran-1-yl)carbazole;9-(7-carbazol-9-yldibenzofuran-2-yl)carbazole;9-(8-carbazol-9-yldibenzofuran-1-yl)carbazole;9-[2-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]carbazole
CID 159764612
9-[5-amino-2-(5-phenyl-[1]benzofuro[3,2-c]carbazol-11-yl)phenyl]carbazol-3-amine
CID 165063889
9-(6-carbazol-9-yldibenzofuran-2-yl)-3-(8-carbazol-9-yldibenzofuran-4-yl)carbazole;3-[6-[9-(6-carbazol-9-yldibenzofuran-2-yl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole;9-[4-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]dibenzofuran-2-yl]carbazole;9-[6-[3-(6-carbazol-9-yldibenzofuran-4-yl)phenyl]dibenzofuran-2-yl]carbazole
CID 159668391
3,6-dibromo-9-(2-dibenzofuran-4-ylphenyl)carbazole
CID 169284938
9-(16-carbazol-9-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-18-yl)carbazole
CID 59147202
3-carbazol-9-yl-9-[6-(8,14-dioxa-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)dibenzofuran-4-yl]carbazole
CID 156678273
3-carbazol-9-yl-9-[2-[2-(4-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170224676
N-[4-(2-carbazol-9-ylphenyl)phenyl]-2-(6-phenyldibenzofuran-4-yl)-N-(3-phenylphenyl)aniline
CID 139544676
9-[4-[2-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-2-yl]carbazole
CID 170228295

Frequently Asked Questions

What is the IUPAC name of 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole?
The IUPAC name of 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole (CID 58099699) is 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole.
What is the SMILES notation for 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole?
The canonical SMILES for 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole is c1ccc(-n2c3ccccc3c3ccccc32)c(-c2cccc3c2oc2c(-c4ccccc4-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)cc23)c1.
What is the InChIKey of 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole?
The InChIKey is LNDZATKPZNAVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H37N3O/c1-9-28-51-39(18-1)40-19-2-10-29-52(40)61(51)38-36-49(46-25-8-16-35-58(46)63-55-32-13-5-22-43(55)44-23-6-14-33-56(44)63)60-50(37-38)48-27-17-26-47(59(48)64-60)45-24-7-15-34-57(45)62-53-30-11-3-20-41(53)42-21-4-12-31-54(42)62/h1-37H.
What are the key properties of 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole?
9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole has a molecular weight of 815.98 g/mol, XLogP of 16.21, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4,6-bis(2-carbazol-9-ylphenyl)dibenzofuran-2-yl]carbazole is sourced from PubChem (CID 58099699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).