5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole

C108H61N7O4 — CID 138661967

IUPAC5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4c5cc(-c6ccc7c(c6)oc6nc8ccc(-c9ccc%10c(c9)oc9nc%11ccccc%11c(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12%11)c9%10)cc8c(-n8c9ccccc9c9c%10oc%11ccccc%11c%10ccc98)c67)ccc5nc5oc6ccccc6c45)c3cc21
InChIInChI=1S/C108H61N7O4/c1-108(2)80-32-14-6-24-63(80)76-56-77-66-27-10-17-35-86(66)114(90(77)57-81(76)108)101-79-53-59(43-50-84(79)110-105-96(101)73-31-13-21-39-92(73)117-105)61-41-45-75-94(55-61)119-107-98(75)100(113-88-37-19-11-30-72(88)95-89(113)51-48-70-67-28-12-20-38-91(67)116-104(70)95)78-52-58(42-49-83(78)111-107)60-40-44-74-93(54-60)118-106-97(74)99(71-29-7-15-33-82(71)109-106)115-87-36-18-9-26-65(87)69-47-46-68-64-25-8-16-34-85(64)112(102(68)103(69)115)62-22-4-3-5-23-62/h3-57H,1-2H3
InChIKeyMXBJEKSUGSOICX-UHFFFAOYSA-N
MW1520.72 g/mol
LogP28.96
Rot. Bonds6

About 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole

5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole (PubChem CID 138661967) has the molecular formula C108H61N7O4 and a molecular weight of 1520.72 g/mol. Its IUPAC name is 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole
PubChem CID138661967
Molecular FormulaC108H61N7O4
Molecular Weight1520.72 g/mol
Exact Mass1519.48
IUPAC Name5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4c5cc(-c6ccc7c(c6)oc6nc8ccc(-c9ccc%10c(c9)oc9nc%11ccccc%11c(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12%11)c9%10)cc8c(-n8c9ccccc9c9c%10oc%11ccccc%11c%10ccc98)c67)ccc5nc5oc6ccccc6c45)c3cc21
InChIInChI=1S/C108H61N7O4/c1-108(2)80-32-14-6-24-63(80)76-56-77-66-27-10-17-35-86(66)114(90(77)57-81(76)108)101-79-53-59(43-50-84(79)110-105-96(101)73-31-13-21-39-92(73)117-105)61-41-45-75-94(55-61)119-107-98(75)100(113-88-37-19-11-30-72(88)95-89(113)51-48-70-67-28-12-20-38-91(67)116-104(70)95)78-52-58(42-49-83(78)111-107)60-40-44-74-93(54-60)118-106-97(74)99(71-29-7-15-33-82(71)109-106)115-87-36-18-9-26-65(87)69-47-46-68-64-25-8-16-34-85(64)112(102(68)103(69)115)62-22-4-3-5-23-62/h3-57H,1-2H3
InChIKeyMXBJEKSUGSOICX-UHFFFAOYSA-N
XLogP28.96
TPSA110.95 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds6
Heavy Atoms119
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001520.72
LogP ≤ 528.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole with MolForge

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Related Compounds

12-[3-([1]benzofuro[3,2-b]quinolin-11-yl)phenyl]-[1]benzofuro[2,3-a]carbazole;5-[3-([1]benzofuro[3,2-b]quinolin-11-yl)phenyl]-[1]benzofuro[3,2-c]carbazole;11-(3-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]quinoline;11-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]-[1]benzofuro[3,2-b]quinoline;11-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-[1]benzofuro[3,2-b]quinoline
CID 158211636
5-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)-[1]benzofuro[3,2-c]carbazole
CID 90057439
12-[3-[3-[5-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]phenyl]-11-(3-phenylphenyl)indolo[2,3-a]carbazole
CID 123161041
11-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-[1]benzofuro[2,3-b]quinoline
CID 138661186
8-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-3-yl)-11-phenyl-[1]benzofuro[3,2-b]carbazole
CID 134223761
5-[3-[2,7-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-2-(3-dibenzofuran-2-ylcarbazol-9-yl)quinoxalin-6-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 126632768
5-[4-dibenzofuran-3-yl-6-(3-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 169014138
5-(4-dibenzofuran-4-ylphenyl)-7,7-dimethyl-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole
CID 138744027
11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[3,2-b]quinoline
CID 138661690
15-(9,9-dimethylfluoren-2-yl)-19-phenyl-4-oxa-15,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene
CID 118545892
5-(9,9-dimethylfluoren-2-yl)-6-(9-phenylcarbazol-2-yl)-[1]benzofuro[3,2-c]carbazole
CID 126656421
7,7-dimethyl-5-[7-[4-[4-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-4-yl]indeno[2,1-b]carbazole
CID 170277611

Frequently Asked Questions

What is the IUPAC name of 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole (CID 138661967) is 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole is CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4c5cc(-c6ccc7c(c6)oc6nc8ccc(-c9ccc%10c(c9)oc9nc%11ccccc%11c(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12%11)c9%10)cc8c(-n8c9ccccc9c9c%10oc%11ccccc%11c%10ccc98)c67)ccc5nc5oc6ccccc6c45)c3cc21.
What is the InChIKey of 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole?
The InChIKey is MXBJEKSUGSOICX-UHFFFAOYSA-N. The full InChI is InChI=1S/C108H61N7O4/c1-108(2)80-32-14-6-24-63(80)76-56-77-66-27-10-17-35-86(66)114(90(77)57-81(76)108)101-79-53-59(43-50-84(79)110-105-96(101)73-31-13-21-39-92(73)117-105)61-41-45-75-94(55-61)119-107-98(75)100(113-88-37-19-11-30-72(88)95-89(113)51-48-70-67-28-12-20-38-91(67)116-104(70)95)78-52-58(42-49-83(78)111-107)60-40-44-74-93(54-60)118-106-97(74)99(71-29-7-15-33-82(71)109-106)115-87-36-18-9-26-65(87)69-47-46-68-64-25-8-16-34-85(64)112(102(68)103(69)115)62-22-4-3-5-23-62/h3-57H,1-2H3.
What are the key properties of 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole?
5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole has a molecular weight of 1520.72 g/mol, XLogP of 28.96, 6 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[11-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-[1]benzofuro[2,3-b]quinolin-9-yl]-9-[11-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzofuro[2,3-b]quinolin-3-yl]-[1]benzofuro[2,3-b]quinolin-11-yl]-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 138661967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).