7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole

C58H32N2O2 — CID 134223614

IUPAC7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-n2c3ccc(-c4ccc5c(c4)c4cc6c(cc4n5-c4ccc5c7c(cccc47)-c4ccccc4-5)oc4ccccc46)cc3c3cc4c(cc32)oc2ccccc24)cc1
InChIInChI=1S/C58H32N2O2/c1-2-11-35(12-3-1)59-50-24-21-33(27-43(50)45-29-47-38-15-6-8-19-54(38)61-56(47)31-52(45)59)34-22-25-51-44(28-34)46-30-48-39-16-7-9-20-55(39)62-57(48)32-53(46)60(51)49-26-23-41-37-14-5-4-13-36(37)40-17-10-18-42(49)58(40)41/h1-32H
InChIKeyWQQXGJYQCPBPKM-UHFFFAOYSA-N
MW788.91 g/mol
LogP16.15
Rot. Bonds3

About 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole

7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole (PubChem CID 134223614) has the molecular formula C58H32N2O2 and a molecular weight of 788.91 g/mol. Its IUPAC name is 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole
PubChem CID134223614
Molecular FormulaC58H32N2O2
Molecular Weight788.91 g/mol
Exact Mass788.25
IUPAC Name7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-n2c3ccc(-c4ccc5c(c4)c4cc6c(cc4n5-c4ccc5c7c(cccc47)-c4ccccc4-5)oc4ccccc46)cc3c3cc4c(cc32)oc2ccccc24)cc1
InChIInChI=1S/C58H32N2O2/c1-2-11-35(12-3-1)59-50-24-21-33(27-43(50)45-29-47-38-15-6-8-19-54(38)61-56(47)31-52(45)59)34-22-25-51-44(28-34)46-30-48-39-16-7-9-20-55(39)62-57(48)32-53(46)60(51)49-26-23-41-37-14-5-4-13-36(37)40-17-10-18-42(49)58(40)41/h1-32H
InChIKeyWQQXGJYQCPBPKM-UHFFFAOYSA-N
XLogP16.15
TPSA36.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500788.91
LogP ≤ 516.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 70658954
2-(9-dibenzofuran-4-ylcarbazol-3-yl)-7-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594574
10-(14-azahexacyclo[12.10.1.02,7.08,13.015,20.021,25]pentacosa-1(24),2,4,6,8(13),9,11,15,17,19,21(25),22-dodecaen-10-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 121386084
3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 71291323
7-phenyl-10-[4-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 134223336
3-[9-(4-fluoranthen-3-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole
CID 71291329
2-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-fluoranthen-3-ylcarbazole
CID 70659172
10-(8-carbazol-9-yldibenzofuran-1-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 134516179
2-methyl-7-phenyl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole
CID 134223454
7-(4-dibenzothiophen-4-ylphenyl)-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole
CID 134223327
3-[9-(2-dibenzofuran-1-ylphenyl)carbazol-2-yl]-9-phenylcarbazole
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Frequently Asked Questions

What is the IUPAC name of 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole (CID 134223614) is 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole is c1ccc(-n2c3ccc(-c4ccc5c(c4)c4cc6c(cc4n5-c4ccc5c7c(cccc47)-c4ccccc4-5)oc4ccccc46)cc3c3cc4c(cc32)oc2ccccc24)cc1.
What is the InChIKey of 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole?
The InChIKey is WQQXGJYQCPBPKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H32N2O2/c1-2-11-35(12-3-1)59-50-24-21-33(27-43(50)45-29-47-38-15-6-8-19-54(38)61-56(47)31-52(45)59)34-22-25-51-44(28-34)46-30-48-39-16-7-9-20-55(39)62-57(48)32-53(46)60(51)49-26-23-41-37-14-5-4-13-36(37)40-17-10-18-42(49)58(40)41/h1-32H.
What are the key properties of 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole?
7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole has a molecular weight of 788.91 g/mol, XLogP of 16.15, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoranthen-3-yl-10-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 134223614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).