11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole

C108H68N8 — CID 88912475

IUPAC11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
SMILESC1=Cc2c(c3ccc4c5ccccc5n(-c5ccccc5)c4c3n2-c2cc(-c3cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c3)cc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)c2)CC1
InChIInChI=1S/C108H68N8/c1-5-29-69(30-6-1)109-93-45-21-13-37-77(93)85-53-57-89-81-41-17-25-49-97(81)113(105(89)101(85)109)73-61-67(62-74(65-73)114-98-50-26-18-42-82(98)90-58-54-86-78-38-14-22-46-94(78)110(102(86)106(90)114)70-31-7-2-8-32-70)68-63-75(115-99-51-27-19-43-83(99)91-59-55-87-79-39-15-23-47-95(79)111(103(87)107(91)115)71-33-9-3-10-34-71)66-76(64-68)116-100-52-28-20-44-84(100)92-60-56-88-80-40-16-24-48-96(80)112(104(88)108(92)116)72-35-11-4-12-36-72/h1-19,21-43,45-66H,20,44H2
InChIKeyKDYNOIYHUXXTDS-UHFFFAOYSA-N
MW1477.79 g/mol
LogP27.94
Rot. Bonds9

About 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole

11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole (PubChem CID 88912475) has the molecular formula C108H68N8 and a molecular weight of 1477.79 g/mol. Its IUPAC name is 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole.

Molecular Properties

Compound Name11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
PubChem CID88912475
Molecular FormulaC108H68N8
Molecular Weight1477.79 g/mol
Exact Mass1476.56
IUPAC Name11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
SMILESC1=Cc2c(c3ccc4c5ccccc5n(-c5ccccc5)c4c3n2-c2cc(-c3cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c3)cc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)c2)CC1
InChIInChI=1S/C108H68N8/c1-5-29-69(30-6-1)109-93-45-21-13-37-77(93)85-53-57-89-81-41-17-25-49-97(81)113(105(89)101(85)109)73-61-67(62-74(65-73)114-98-50-26-18-42-82(98)90-58-54-86-78-38-14-22-46-94(78)110(102(86)106(90)114)70-31-7-2-8-32-70)68-63-75(115-99-51-27-19-43-83(99)91-59-55-87-79-39-15-23-47-95(79)111(103(87)107(91)115)71-33-9-3-10-34-71)66-76(64-68)116-100-52-28-20-44-84(100)92-60-56-88-80-40-16-24-48-96(80)112(104(88)108(92)116)72-35-11-4-12-36-72/h1-19,21-43,45-66H,20,44H2
InChIKeyKDYNOIYHUXXTDS-UHFFFAOYSA-N
XLogP27.94
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001477.79
LogP ≤ 527.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
The IUPAC name of 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole (CID 88912475) is 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole.
What is the SMILES notation for 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
The canonical SMILES for 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole is C1=Cc2c(c3ccc4c5ccccc5n(-c5ccccc5)c4c3n2-c2cc(-c3cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c3)cc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)c2)CC1.
What is the InChIKey of 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
The InChIKey is KDYNOIYHUXXTDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C108H68N8/c1-5-29-69(30-6-1)109-93-45-21-13-37-77(93)85-53-57-89-81-41-17-25-49-97(81)113(105(89)101(85)109)73-61-67(62-74(65-73)114-98-50-26-18-42-82(98)90-58-54-86-78-38-14-22-46-94(78)110(102(86)106(90)114)70-31-7-2-8-32-70)68-63-75(115-99-51-27-19-43-83(99)91-59-55-87-79-39-15-23-47-95(79)111(103(87)107(91)115)71-33-9-3-10-34-71)66-76(64-68)116-100-52-28-20-44-84(100)92-60-56-88-80-40-16-24-48-96(80)112(104(88)108(92)116)72-35-11-4-12-36-72/h1-19,21-43,45-66H,20,44H2.
What are the key properties of 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole has a molecular weight of 1477.79 g/mol, XLogP of 27.94, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 11-phenyl-12-[3-[3-(12-phenyl-7,8-dihydroindolo[2,3-a]carbazol-11-yl)-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole is sourced from PubChem (CID 88912475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).