5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole

C72H45N9 — CID 146573174

IUPAC5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3-n3c4ccccc4c4ccccc43)nc(-c3ccccc3-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccccc5-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)n2)cc1
InChIInChI=1S/C72H45N9/c1-4-24-46(25-5-1)67-73-68(47-26-6-2-7-27-47)75-70(74-67)56-36-16-23-43-63(56)81-59-39-19-12-32-51(59)52-44-45-64-65(66(52)81)53-33-13-20-40-60(53)80(64)62-42-22-15-35-55(62)72-77-69(48-28-8-3-9-29-48)76-71(78-72)54-34-14-21-41-61(54)79-57-37-17-10-30-49(57)50-31-11-18-38-58(50)79/h1-45H
InChIKeyBPWXGCILTGLSKL-UHFFFAOYSA-N
MW1036.21 g/mol
LogP17.35
Rot. Bonds9

About 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole

5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole (PubChem CID 146573174) has the molecular formula C72H45N9 and a molecular weight of 1036.21 g/mol. Its IUPAC name is 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole
PubChem CID146573174
Molecular FormulaC72H45N9
Molecular Weight1036.21 g/mol
Exact Mass1035.38
IUPAC Name5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3-n3c4ccccc4c4ccccc43)nc(-c3ccccc3-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccccc5-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)n2)cc1
InChIInChI=1S/C72H45N9/c1-4-24-46(25-5-1)67-73-68(47-26-6-2-7-27-47)75-70(74-67)56-36-16-23-43-63(56)81-59-39-19-12-32-51(59)52-44-45-64-65(66(52)81)53-33-13-20-40-60(53)80(64)62-42-22-15-35-55(62)72-77-69(48-28-8-3-9-29-48)76-71(78-72)54-34-14-21-41-61(54)79-57-37-17-10-30-49(57)50-31-11-18-38-58(50)79/h1-45H
InChIKeyBPWXGCILTGLSKL-UHFFFAOYSA-N
XLogP17.35
TPSA92.13 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms81
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001036.21
LogP ≤ 517.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole with MolForge

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Related Compounds

5-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole
CID 169037359
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[2-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[3,2-c]carbazole
CID 169037460
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-[2-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[3,2-c]carbazole
CID 169036916
5-[2-[4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-phenylindolo[3,2-c]carbazole
CID 155183616
boranuide;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 158893462
5-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 139497018
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-[2-(4-phenyl-6-quinolin-2-yl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole
CID 169037291
5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole
CID 169037384
5-(2,3-diphenylphenyl)-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[3,2-c]carbazole
CID 168835041
5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole
CID 149424415
5-[2-(2,6-diphenylpyrimidin-4-yl)phenyl]-12-naphthalen-1-ylindolo[3,2-c]carbazole
CID 155631323
5,12-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole sulfide
CID 158568390

Frequently Asked Questions

What is the IUPAC name of 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole?
The IUPAC name of 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole (CID 146573174) is 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole.
What is the SMILES notation for 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole?
The canonical SMILES for 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole is c1ccc(-c2nc(-c3ccccc3-n3c4ccccc4c4ccccc43)nc(-c3ccccc3-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccccc5-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)n2)cc1.
What is the InChIKey of 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole?
The InChIKey is BPWXGCILTGLSKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H45N9/c1-4-24-46(25-5-1)67-73-68(47-26-6-2-7-27-47)75-70(74-67)56-36-16-23-43-63(56)81-59-39-19-12-32-51(59)52-44-45-64-65(66(52)81)53-33-13-20-40-60(53)80(64)62-42-22-15-35-55(62)72-77-69(48-28-8-3-9-29-48)76-71(78-72)54-34-14-21-41-61(54)79-57-37-17-10-30-49(57)50-31-11-18-38-58(50)79/h1-45H.
What are the key properties of 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole?
5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole has a molecular weight of 1036.21 g/mol, XLogP of 17.35, 9 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[4-(2-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]indolo[3,2-c]carbazole is sourced from PubChem (CID 146573174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).