7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole

C108H66N4O2 — CID 167192720

IUPAC7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2ccc3c4ccc(-c5ccc(-c6cccc(-c7ccc8c9ccc(-c%10ccccc%10)cc9n(-c9ccc(-c%10ccc(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14oc%13c%12%11)cc%10)cc9)c8c7)c6)cc5)cc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7cc8c(cc76)oc6ccccc68)cc5)cc4)c3c2)cc1
InChIInChI=1S/C108H66N4O2/c1-3-16-67(17-4-1)77-42-54-87-89-56-44-79(63-101(89)110(99(87)61-77)82-48-36-70(37-49-82)69-34-46-81(47-35-69)109-97-26-11-8-23-86(97)95-65-96-92-25-10-13-28-104(92)113-106(96)66-103(95)109)74-32-30-73(31-33-74)75-20-15-21-76(60-75)80-45-57-90-88-55-43-78(68-18-5-2-6-19-68)62-100(88)111(102(90)64-80)83-50-38-71(39-51-83)72-40-52-84(53-41-72)112-98-27-12-7-22-85(98)93-58-59-94-91-24-9-14-29-105(91)114-108(94)107(93)112/h1-66H
InChIKeyXRPKFZCWFNUTCE-UHFFFAOYSA-N
MW1451.74 g/mol
LogP29.54
Rot. Bonds11

About 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole

7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole (PubChem CID 167192720) has the molecular formula C108H66N4O2 and a molecular weight of 1451.74 g/mol. Its IUPAC name is 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole
PubChem CID167192720
Molecular FormulaC108H66N4O2
Molecular Weight1451.74 g/mol
Exact Mass1450.52
IUPAC Name7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2ccc3c4ccc(-c5ccc(-c6cccc(-c7ccc8c9ccc(-c%10ccccc%10)cc9n(-c9ccc(-c%10ccc(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14oc%13c%12%11)cc%10)cc9)c8c7)c6)cc5)cc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7cc8c(cc76)oc6ccccc68)cc5)cc4)c3c2)cc1
InChIInChI=1S/C108H66N4O2/c1-3-16-67(17-4-1)77-42-54-87-89-56-44-79(63-101(89)110(99(87)61-77)82-48-36-70(37-49-82)69-34-46-81(47-35-69)109-97-26-11-8-23-86(97)95-65-96-92-25-10-13-28-104(92)113-106(96)66-103(95)109)74-32-30-73(31-33-74)75-20-15-21-76(60-75)80-45-57-90-88-55-43-78(68-18-5-2-6-19-68)62-100(88)111(102(90)64-80)83-50-38-71(39-51-83)72-40-52-84(53-41-72)112-98-27-12-7-22-85(98)93-58-59-94-91-24-9-14-29-105(91)114-108(94)107(93)112/h1-66H
InChIKeyXRPKFZCWFNUTCE-UHFFFAOYSA-N
XLogP29.54
TPSA46.00 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms114
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001451.74
LogP ≤ 529.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole with MolForge

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Related Compounds

12-[4-(4-carbazol-9-ylphenyl)phenyl]-2-[4-[11-[4-(4-carbazol-9-ylphenyl)phenyl]-[1]benzofuro[3,2-b]carbazol-2-yl]phenyl]-9-phenyl-[1]benzofuro[2,3-a]carbazole
CID 167193369
12-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole
CID 166509852
3-(5,7-diphenylindolo[2,3-b]carbazol-3-yl)-12-phenyl-[1]benzofuro[2,3-a]carbazole
CID 134223766
12-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole
CID 166510073
12-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-[1]benzofuro[2,3-a]carbazole
CID 126580353
5-dibenzofuran-3-yl-7-[4-(3-phenylphenyl)phenyl]indolo[2,3-b]carbazole
CID 164847658
7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole
CID 167192760
7-[4-(8-phenyldibenzofuran-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 171612092
9-[4-dibenzofuran-2-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-12-phenyl-[1]benzofuro[2,3-a]carbazole
CID 163603085
15-phenyl-11-[4-(6-phenyl-2-pyridinyl)phenyl]-18-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene
CID 129141926
12-[3-(4-dibenzofuran-2-ylphenyl)phenyl]-[1]benzofuro[2,3-a]carbazole
CID 163763332
8-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-12-[4-(3-phenylphenyl)phenyl]-[1]benzofuro[2,3-a]carbazole
CID 163611677

Frequently Asked Questions

What is the IUPAC name of 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole (CID 167192720) is 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole is c1ccc(-c2ccc3c4ccc(-c5ccc(-c6cccc(-c7ccc8c9ccc(-c%10ccccc%10)cc9n(-c9ccc(-c%10ccc(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14oc%13c%12%11)cc%10)cc9)c8c7)c6)cc5)cc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7cc8c(cc76)oc6ccccc68)cc5)cc4)c3c2)cc1.
What is the InChIKey of 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole?
The InChIKey is XRPKFZCWFNUTCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C108H66N4O2/c1-3-16-67(17-4-1)77-42-54-87-89-56-44-79(63-101(89)110(99(87)61-77)82-48-36-70(37-49-82)69-34-46-81(47-35-69)109-97-26-11-8-23-86(97)95-65-96-92-25-10-13-28-104(92)113-106(96)66-103(95)109)74-32-30-73(31-33-74)75-20-15-21-76(60-75)80-45-57-90-88-55-43-78(68-18-5-2-6-19-68)62-100(88)111(102(90)64-80)83-50-38-71(39-51-83)72-40-52-84(53-41-72)112-98-27-12-7-22-85(98)93-58-59-94-91-24-9-14-29-105(91)114-108(94)107(93)112/h1-66H.
What are the key properties of 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole?
7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole has a molecular weight of 1451.74 g/mol, XLogP of 29.54, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-[4-[2-[4-[3-[9-[4-[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-7-phenylcarbazol-2-yl]phenyl]phenyl]-7-phenylcarbazol-9-yl]phenyl]phenyl]-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 167192720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).