9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene

C114H70N12 — CID 163928350

IUPAC9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccc5c(c4)c4cc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccc(-n9c%10ccccc%10c%10c%11c%12ccccc%12n(-c%12ccc(-n%13c%14ccccc%14c%14ccccc%14%13)cc%12)c%11ccc%109)cc8)n7)cc6)ccc4n5-c4ccccc4)cc3)n2)cc1
InChIInChI=1S/C114H70N12/c1-5-25-72(26-6-1)109-115-110(73-27-7-2-8-28-73)118-113(117-109)77-51-56-81(57-52-77)125-97-41-21-15-35-87(97)93-70-106-94(69-105(93)125)88-36-16-22-42-98(88)126(106)84-62-64-102-92(68-84)91-67-78(53-63-101(91)121(102)79-31-11-4-12-32-79)71-45-47-75(48-46-71)112-116-111(74-29-9-3-10-30-74)119-114(120-112)76-49-54-80(55-50-76)123-99-43-23-17-37-89(99)107-103(123)65-66-104-108(107)90-38-18-24-44-100(90)124(104)83-60-58-82(59-61-83)122-95-39-19-13-33-85(95)86-34-14-20-40-96(86)122/h1-70H
InChIKeyRGLRZZDIOWUVQL-UHFFFAOYSA-N
MW1607.90 g/mol
LogP28.31
Rot. Bonds13

About 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene

9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene (PubChem CID 163928350) has the molecular formula C114H70N12 and a molecular weight of 1607.90 g/mol. Its IUPAC name is 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene.

Molecular Properties

Compound Name9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
PubChem CID163928350
Molecular FormulaC114H70N12
Molecular Weight1607.90 g/mol
Exact Mass1606.58
IUPAC Name9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccc5c(c4)c4cc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccc(-n9c%10ccccc%10c%10c%11c%12ccccc%12n(-c%12ccc(-n%13c%14ccccc%14c%14ccccc%14%13)cc%12)c%11ccc%109)cc8)n7)cc6)ccc4n5-c4ccccc4)cc3)n2)cc1
InChIInChI=1S/C114H70N12/c1-5-25-72(26-6-1)109-115-110(73-27-7-2-8-28-73)118-113(117-109)77-51-56-81(57-52-77)125-97-41-21-15-35-87(97)93-70-106-94(69-105(93)125)88-36-16-22-42-98(88)126(106)84-62-64-102-92(68-84)91-67-78(53-63-101(91)121(102)79-31-11-4-12-32-79)71-45-47-75(48-46-71)112-116-111(74-29-9-3-10-30-74)119-114(120-112)76-49-54-80(55-50-76)123-99-43-23-17-37-89(99)107-103(123)65-66-104-108(107)90-38-18-24-44-100(90)124(104)83-60-58-82(59-61-83)122-95-39-19-13-33-85(95)86-34-14-20-40-96(86)122/h1-70H
InChIKeyRGLRZZDIOWUVQL-UHFFFAOYSA-N
XLogP28.31
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001607.90
LogP ≤ 528.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene with MolForge

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Related Compounds

9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5,14-diphenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 139481059
3-carbazol-9-yl-9-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 153459439
3-carbazol-9-yl-9-[9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]carbazole
CID 90211361
3-[9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole;3-[9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole;3-[9-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 158366423
3-[9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole;3-[9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 158365808
9-[4-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 139496806
3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 90211376
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[4-(2-phenylcarbazol-9-yl)phenyl]carbazole
CID 88878713
3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3,6-di(carbazol-9-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 162055470
11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-b]carbazole
CID 139481204
3-carbazol-9-yl-9-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 148633406
3-carbazol-9-yl-9-[4-[4-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 130353815

Frequently Asked Questions

What is the IUPAC name of 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
The IUPAC name of 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene (CID 163928350) is 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene.
What is the SMILES notation for 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
The canonical SMILES for 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccc5c(c4)c4cc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccc(-n9c%10ccccc%10c%10c%11c%12ccccc%12n(-c%12ccc(-n%13c%14ccccc%14c%14ccccc%14%13)cc%12)c%11ccc%109)cc8)n7)cc6)ccc4n5-c4ccccc4)cc3)n2)cc1.
What is the InChIKey of 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
The InChIKey is RGLRZZDIOWUVQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C114H70N12/c1-5-25-72(26-6-1)109-115-110(73-27-7-2-8-28-73)118-113(117-109)77-51-56-81(57-52-77)125-97-41-21-15-35-87(97)93-70-106-94(69-105(93)125)88-36-16-22-42-98(88)126(106)84-62-64-102-92(68-84)91-67-78(53-63-101(91)121(102)79-31-11-4-12-32-79)71-45-47-75(48-46-71)112-116-111(74-29-9-3-10-30-74)119-114(120-112)76-49-54-80(55-50-76)123-99-43-23-17-37-89(99)107-103(123)65-66-104-108(107)90-38-18-24-44-100(90)124(104)83-60-58-82(59-61-83)122-95-39-19-13-33-85(95)86-34-14-20-40-96(86)122/h1-70H.
What are the key properties of 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene?
9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene has a molecular weight of 1607.90 g/mol, XLogP of 28.31, 13 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-carbazol-9-ylphenyl)-14-[4-[4-[4-[6-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-b]carbazol-11-yl]-9-phenylcarbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene is sourced from PubChem (CID 163928350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).