5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole

C147H96F6N12 — CID 138547428

IUPAC5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole
SMILESCC1C=Cc2c(c3c(ccc4c5ccccc5n(-c5ccccc5)c43)n2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6c(c5)-c5ccc7c(c5C6(C)C)c5ccccc5n7-c5ccc(C(F)(F)F)cc5-c5cc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)ccc5-n5c6ccccc6c6c7c(ccc65)-c5ccccc5C7(C)C)c4)n3)cc2-c2cc(C(F)(F)F)ccc2-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)C1
InChIInChI=1S/C147H96F6N12/c1-85-58-69-125-113(78-85)133-129(77-67-104-100-48-23-29-54-117(100)161(137(104)133)97-44-19-10-20-45-97)165(125)122-71-61-93(82-110(122)112-84-95(147(151,152)153)63-73-124(112)164-120-57-32-26-51-107(120)132-128(164)76-66-103-99-47-22-28-53-116(99)160(136(103)132)96-42-17-9-18-43-96)143-158-140(88-38-15-8-16-39-88)155-141(159-143)91-41-33-40-89(79-91)90-59-68-115-108(80-90)102-65-75-127-131(135(102)145(115,4)5)106-50-25-31-56-119(106)163(127)123-72-62-94(146(148,149)150)83-111(123)109-81-92(142-156-138(86-34-11-6-12-35-86)154-139(157-142)87-36-13-7-14-37-87)60-70-121(109)162-118-55-30-24-49-105(118)130-126(162)74-64-101-98-46-21-27-52-114(98)144(2,3)134(101)130/h6-77,79-85H,78H2,1-5H3
InChIKeyCOTQUTCNYISPMK-UHFFFAOYSA-N
MW2144.46 g/mol
LogP38.34
Rot. Bonds15

About 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole

5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole (PubChem CID 138547428) has the molecular formula C147H96F6N12 and a molecular weight of 2144.46 g/mol. Its IUPAC name is 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole
PubChem CID138547428
Molecular FormulaC147H96F6N12
Molecular Weight2144.46 g/mol
Exact Mass2142.78
IUPAC Name5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole
SMILESCC1C=Cc2c(c3c(ccc4c5ccccc5n(-c5ccccc5)c43)n2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6c(c5)-c5ccc7c(c5C6(C)C)c5ccccc5n7-c5ccc(C(F)(F)F)cc5-c5cc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)ccc5-n5c6ccccc6c6c7c(ccc65)-c5ccccc5C7(C)C)c4)n3)cc2-c2cc(C(F)(F)F)ccc2-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)C1
InChIInChI=1S/C147H96F6N12/c1-85-58-69-125-113(78-85)133-129(77-67-104-100-48-23-29-54-117(100)161(137(104)133)97-44-19-10-20-45-97)165(125)122-71-61-93(82-110(122)112-84-95(147(151,152)153)63-73-124(112)164-120-57-32-26-51-107(120)132-128(164)76-66-103-99-47-22-28-53-116(99)160(136(103)132)96-42-17-9-18-43-96)143-158-140(88-38-15-8-16-39-88)155-141(159-143)91-41-33-40-89(79-91)90-59-68-115-108(80-90)102-65-75-127-131(135(102)145(115,4)5)106-50-25-31-56-119(106)163(127)123-72-62-94(146(148,149)150)83-111(123)109-81-92(142-156-138(86-34-11-6-12-35-86)154-139(157-142)87-36-13-7-14-37-87)60-70-121(109)162-118-55-30-24-49-105(118)130-126(162)74-64-101-98-46-21-27-52-114(98)144(2,3)134(101)130/h6-77,79-85H,78H2,1-5H3
InChIKeyCOTQUTCNYISPMK-UHFFFAOYSA-N
XLogP38.34
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002144.46
LogP ≤ 538.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole?
The IUPAC name of 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole (CID 138547428) is 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole.
What is the SMILES notation for 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole?
The canonical SMILES for 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole is CC1C=Cc2c(c3c(ccc4c5ccccc5n(-c5ccccc5)c43)n2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6c(c5)-c5ccc7c(c5C6(C)C)c5ccccc5n7-c5ccc(C(F)(F)F)cc5-c5cc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)ccc5-n5c6ccccc6c6c7c(ccc65)-c5ccccc5C7(C)C)c4)n3)cc2-c2cc(C(F)(F)F)ccc2-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)C1.
What is the InChIKey of 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole?
The InChIKey is COTQUTCNYISPMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C147H96F6N12/c1-85-58-69-125-113(78-85)133-129(77-67-104-100-48-23-29-54-117(100)161(137(104)133)97-44-19-10-20-45-97)165(125)122-71-61-93(82-110(122)112-84-95(147(151,152)153)63-73-124(112)164-120-57-32-26-51-107(120)132-128(164)76-66-103-99-47-22-28-53-116(99)160(136(103)132)96-42-17-9-18-43-96)143-158-140(88-38-15-8-16-39-88)155-141(159-143)91-41-33-40-89(79-91)90-59-68-115-108(80-90)102-65-75-127-131(135(102)145(115,4)5)106-50-25-31-56-119(106)163(127)123-72-62-94(146(148,149)150)83-111(123)109-81-92(142-156-138(86-34-11-6-12-35-86)154-139(157-142)87-36-13-7-14-37-87)60-70-121(109)162-118-55-30-24-49-105(118)130-126(162)74-64-101-98-46-21-27-52-114(98)144(2,3)134(101)130/h6-77,79-85H,78H2,1-5H3.
What are the key properties of 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole?
5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole has a molecular weight of 2144.46 g/mol, XLogP of 38.34, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[5-[4-[3-[5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole is sourced from PubChem (CID 138547428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).