12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole

C144H99N15 — CID 163418432

IUPAC12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)-c3ccccc3C4(C)C)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)n5)c4c32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6cccc7c6C(C)(C)c6ccccc6-7)n5)c4c32)c([2H])c1[2H]
InChIInChI=1S/3C48H33N5/c1-48(2)39-25-12-9-20-32(39)35-23-15-24-38(42(35)48)46-49-45(30-16-5-3-6-17-30)50-47(51-46)53-41-27-14-11-22-34(41)37-29-28-36-33-21-10-13-26-40(33)52(43(36)44(37)53)31-18-7-4-8-19-31;1-48(2)39-22-12-9-19-33(39)38-29-31(25-28-40(38)48)46-49-45(30-15-5-3-6-16-30)50-47(51-46)53-42-24-14-11-21-35(42)37-27-26-36-34-20-10-13-23-41(34)52(43(36)44(37)53)32-17-7-4-8-18-32;1-48(2)39-22-12-9-19-33(39)34-26-25-31(29-40(34)48)46-49-45(30-15-5-3-6-16-30)50-47(51-46)53-42-24-14-11-21-36(42)38-28-27-37-35-20-10-13-23-41(35)52(43(37)44(38)53)32-17-7-4-8-18-32/h3*3-29H,1-2H3/i4D,7D,8D,18D,19D;3D,5D,6D,15D,16D;4D,7D,8D,17D,18D
InChIKeyAGKJVFUSFSVLFG-ZGCIVJEQSA-N
MW2054.57 g/mol
LogP35.12
Rot. Bonds12

About 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole

12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole (PubChem CID 163418432) has the molecular formula C144H99N15 and a molecular weight of 2054.57 g/mol. Its IUPAC name is 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole
PubChem CID163418432
Molecular FormulaC144H99N15
Molecular Weight2054.57 g/mol
Exact Mass2052.91
IUPAC Name12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)-c3ccccc3C4(C)C)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)n5)c4c32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6cccc7c6C(C)(C)c6ccccc6-7)n5)c4c32)c([2H])c1[2H]
InChIInChI=1S/3C48H33N5/c1-48(2)39-25-12-9-20-32(39)35-23-15-24-38(42(35)48)46-49-45(30-16-5-3-6-17-30)50-47(51-46)53-41-27-14-11-22-34(41)37-29-28-36-33-21-10-13-26-40(33)52(43(36)44(37)53)31-18-7-4-8-19-31;1-48(2)39-22-12-9-19-33(39)38-29-31(25-28-40(38)48)46-49-45(30-15-5-3-6-16-30)50-47(51-46)53-42-24-14-11-21-35(42)37-27-26-36-34-20-10-13-23-41(34)52(43(36)44(37)53)32-17-7-4-8-18-32;1-48(2)39-22-12-9-19-33(39)34-26-25-31(29-40(34)48)46-49-45(30-15-5-3-6-16-30)50-47(51-46)53-42-24-14-11-21-36(42)38-28-27-37-35-20-10-13-23-41(35)52(43(37)44(38)53)32-17-7-4-8-18-32/h3*3-29H,1-2H3/i4D,7D,8D,18D,19D;3D,5D,6D,15D,16D;4D,7D,8D,17D,18D
InChIKeyAGKJVFUSFSVLFG-ZGCIVJEQSA-N
XLogP35.12
TPSA145.59 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds12
Heavy Atoms159
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002054.57
LogP ≤ 535.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole with MolForge

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Related Compounds

12-[4,6-bis(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-(9,9-dimethylfluoren-2-yl)indolo[2,3-a]carbazole
CID 162425061
12-[4-(9,9-dimethylfluoren-3-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-[3-(2-phenylphenyl)phenyl]indolo[2,3-a]carbazole
CID 165165441
1-(9,9-dimethylfluoren-1-yl)-9-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)carbazole;1-(9,9-dimethylfluoren-2-yl)-9-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)carbazole;1-(9,9-dimethylfluoren-3-yl)-9-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)carbazole;1-(9,9-dimethylfluoren-4-yl)-9-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)carbazole
CID 157312768
9-[4-[4-(9,9-dimethylfluoren-2-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-(2,3,4,5,6-pentadeuteriophenyl)dibenzofuran-2-yl]carbazole
CID 163488115
12-[4,6-bis(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-(9,9-dimethylfluoren-1-yl)indolo[2,3-a]carbazole
CID 162425093
9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-(9,9-dimethylfluoren-2-yl)carbazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-1-yl]-9-phenylcarbazole;1-(9-phenylcarbazol-2-yl)-9-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
CID 157295181
11-(9,9-dimethylfluoren-2-yl)-12-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[2,3-a]carbazole
CID 121385363
1-(9,9-dimethylfluoren-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 147949558
12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-[2-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazole
CID 165165638
6-(9,9-dimethylfluoren-3-yl)-1-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 145327523
11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 58059187
2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-8-yl]-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
CID 66797829

Frequently Asked Questions

What is the IUPAC name of 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole?
The IUPAC name of 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole (CID 163418432) is 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole.
What is the SMILES notation for 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole?
The canonical SMILES for 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole is [2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)-c3ccccc3C4(C)C)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)n5)c4c32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6cccc7c6C(C)(C)c6ccccc6-7)n5)c4c32)c([2H])c1[2H].
What is the InChIKey of 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole?
The InChIKey is AGKJVFUSFSVLFG-ZGCIVJEQSA-N. The full InChI is InChI=1S/3C48H33N5/c1-48(2)39-25-12-9-20-32(39)35-23-15-24-38(42(35)48)46-49-45(30-16-5-3-6-17-30)50-47(51-46)53-41-27-14-11-22-34(41)37-29-28-36-33-21-10-13-26-40(33)52(43(36)44(37)53)31-18-7-4-8-19-31;1-48(2)39-22-12-9-19-33(39)38-29-31(25-28-40(38)48)46-49-45(30-15-5-3-6-16-30)50-47(51-46)53-42-24-14-11-21-35(42)37-27-26-36-34-20-10-13-23-41(34)52(43(36)44(37)53)32-17-7-4-8-18-32;1-48(2)39-22-12-9-19-33(39)34-26-25-31(29-40(34)48)46-49-45(30-15-5-3-6-16-30)50-47(51-46)53-42-24-14-11-21-36(42)38-28-27-37-35-20-10-13-23-41(35)52(43(37)44(38)53)32-17-7-4-8-18-32/h3*3-29H,1-2H3/i4D,7D,8D,18D,19D;3D,5D,6D,15D,16D;4D,7D,8D,17D,18D.
What are the key properties of 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole?
12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole has a molecular weight of 2054.57 g/mol, XLogP of 35.12, 12 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[4-(9,9-dimethylfluoren-3-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole;12-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-11-(2,3,4,5,6-pentadeuteriophenyl)indolo[2,3-a]carbazole is sourced from PubChem (CID 163418432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).