5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole

C67H41N9 — CID 88917460

IUPAC5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9cccc(-c%10ccccc%10)n9)c8c76)n5)c43)n2)cc1
InChIInChI=1S/C67H41N9/c1-4-20-42(21-5-1)52-30-18-36-59(68-52)74-54-32-14-10-26-45(54)48-40-41-58-61(62(48)74)51-29-13-17-35-57(51)73(58)66-70-65(44-24-8-3-9-25-44)71-67(72-66)76-56-34-16-12-28-47(56)50-39-38-49-46-27-11-15-33-55(46)75(63(49)64(50)76)60-37-19-31-53(69-60)43-22-6-2-7-23-43/h1-41H
InChIKeyKIONSINCESKOSB-UHFFFAOYSA-N
MW972.13 g/mol
LogP16.05
Rot. Bonds7

About 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole

5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole (PubChem CID 88917460) has the molecular formula C67H41N9 and a molecular weight of 972.13 g/mol. Its IUPAC name is 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole
PubChem CID88917460
Molecular FormulaC67H41N9
Molecular Weight972.13 g/mol
Exact Mass971.35
IUPAC Name5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9cccc(-c%10ccccc%10)n9)c8c76)n5)c43)n2)cc1
InChIInChI=1S/C67H41N9/c1-4-20-42(21-5-1)52-30-18-36-59(68-52)74-54-32-14-10-26-45(54)48-40-41-58-61(62(48)74)51-29-13-17-35-57(51)73(58)66-70-65(44-24-8-3-9-25-44)71-67(72-66)76-56-34-16-12-28-47(56)50-39-38-49-46-27-11-15-33-55(46)75(63(49)64(50)76)60-37-19-31-53(69-60)43-22-6-2-7-23-43/h1-41H
InChIKeyKIONSINCESKOSB-UHFFFAOYSA-N
XLogP16.05
TPSA84.17 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500972.13
LogP ≤ 516.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole with MolForge

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Related Compounds

12-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;9,18-diphenyl-27-[4-[4-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]phenyl]-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene;5-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)-5-[12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazol-5-yl]phenyl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole;5-[4-phenyl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole;12-phenyl-5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole;5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole
CID 162175204
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-14-(6-phenyl-2-pyridinyl)-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 118504570
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-c]carbazole
CID 174179677
5,12-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole sulfide
CID 158568390
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole
CID 170268493
5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;12-phenyl-5-(4-phenylphenyl)indolo[3,2-c]carbazole;5-(4-phenylphenyl)-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole
CID 158271663
12-[4-carbazol-9-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenylindolo[3,2-c]carbazole
CID 158439679
5-(3-carbazol-9-ylphenyl)-12-[4-phenyl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole
CID 88917477
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-[3-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazol-5-yl]phenyl]indolo[3,2-c]carbazole
CID 88917516
5,12-bis[6-(3-carbazol-9-ylphenyl)-2-pyridinyl]indolo[3,2-c]carbazole
CID 58570039
5-phenyl-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole
CID 129141708
9,14-bis(6-carbazol-9-yl-2-pyridinyl)-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;9,14-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-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;9,14-bis(6-phenyl-2-pyridinyl)-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-(6-carbazol-9-yl-2-pyridinyl)-14-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-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-(6-carbazol-9-yl-2-pyridinyl)-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;9-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]-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 157499027

Frequently Asked Questions

What is the IUPAC name of 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole?
The IUPAC name of 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole (CID 88917460) is 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole.
What is the SMILES notation for 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole?
The canonical SMILES for 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole is c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9cccc(-c%10ccccc%10)n9)c8c76)n5)c43)n2)cc1.
What is the InChIKey of 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole?
The InChIKey is KIONSINCESKOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H41N9/c1-4-20-42(21-5-1)52-30-18-36-59(68-52)74-54-32-14-10-26-45(54)48-40-41-58-61(62(48)74)51-29-13-17-35-57(51)73(58)66-70-65(44-24-8-3-9-25-44)71-67(72-66)76-56-34-16-12-28-47(56)50-39-38-49-46-27-11-15-33-55(46)75(63(49)64(50)76)60-37-19-31-53(69-60)43-22-6-2-7-23-43/h1-41H.
What are the key properties of 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole?
5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole has a molecular weight of 972.13 g/mol, XLogP of 16.05, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-phenyl-6-[11-(6-phenyl-2-pyridinyl)indolo[2,3-a]carbazol-12-yl]-1,3,5-triazin-2-yl]-12-(6-phenyl-2-pyridinyl)indolo[3,2-c]carbazole is sourced from PubChem (CID 88917460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).