7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole

C61H43N — CID 134370705

IUPAC7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole
SMILESCc1cc(C)cc(-c2cccc(-c3cccc(-n4c5ccc(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)cc5c5c6ccccc6ccc54)c3)c2)c1
InChIInChI=1S/C61H43N/c1-40-33-41(2)35-48(34-40)44-17-13-16-43(36-44)45-18-14-23-51(37-45)62-58-31-29-46(38-55(58)60-52-24-10-9-15-42(52)28-32-59(60)62)47-27-30-54-53-25-11-12-26-56(53)61(57(54)39-47,49-19-5-3-6-20-49)50-21-7-4-8-22-50/h3-39H,1-2H3
InChIKeySJTDNJDNJXGCLD-UHFFFAOYSA-N
MW790.02 g/mol
LogP15.92
Rot. Bonds6

About 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole

7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole (PubChem CID 134370705) has the molecular formula C61H43N and a molecular weight of 790.02 g/mol. Its IUPAC name is 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole.

Molecular Properties

Compound Name7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole
PubChem CID134370705
Molecular FormulaC61H43N
Molecular Weight790.02 g/mol
Exact Mass789.34
IUPAC Name7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole
SMILESCc1cc(C)cc(-c2cccc(-c3cccc(-n4c5ccc(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)cc5c5c6ccccc6ccc54)c3)c2)c1
InChIInChI=1S/C61H43N/c1-40-33-41(2)35-48(34-40)44-17-13-16-43(36-44)45-18-14-23-51(37-45)62-58-31-29-46(38-55(58)60-52-24-10-9-15-42(52)28-32-59(60)62)47-27-30-54-53-25-11-12-26-56(53)61(57(54)39-47,49-19-5-3-6-20-49)50-21-7-4-8-22-50/h3-39H,1-2H3
InChIKeySJTDNJDNJXGCLD-UHFFFAOYSA-N
XLogP15.92
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500790.02
LogP ≤ 515.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-[4-[3-(3,5-dimethylphenyl)-5-phenylphenyl]phenyl]-10-(9,9'-spirobi[fluorene]-2-yl)benzo[c]carbazole
CID 134370703
7-(3,5-dimethylphenyl)-10-(9,9'-spirobi[fluorene]-2-yl)benzo[c]carbazole
CID 134370708
9,9-diphenyl-N-[4-(7-phenylbenzo[c]carbazol-10-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 118282644
6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole
CID 161056569
9-(9,9-diphenylfluoren-2-yl)-2-[3-(3-methylphenyl)phenyl]carbazole
CID 90215950
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118449222
9-[4-[4-[4-[4-[3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]phenyl]phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 134354328
3-[9-[3-[3-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 154590619
5-(9,9-dimethylfluoren-2-yl)-12,12-dimethylindeno[1,2-c]carbazole;12,12-dimethyl-5-(3-naphthalen-2-ylphenyl)indeno[1,2-c]carbazole;12,12-dimethyl-5-(3-phenanthren-3-ylphenyl)indeno[1,2-c]carbazole;12,12-dimethyl-5-(9,9'-spirobi[fluorene]-2-yl)indeno[1,2-c]carbazole;5-(9,9-diphenylfluoren-2-yl)-12,12-dimethylindeno[1,2-c]carbazole
CID 157484396
5-[3-[4-(9,9-diphenylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3,9-diphenylcarbazole
CID 129265297
N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9,9-diphenyl-N-(2-phenylphenyl)fluoren-2-amine;N-[4-[9-[7-(3,5-dimethylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 158875006

Frequently Asked Questions

What is the IUPAC name of 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole?
The IUPAC name of 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole (CID 134370705) is 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole.
What is the SMILES notation for 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole?
The canonical SMILES for 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole is Cc1cc(C)cc(-c2cccc(-c3cccc(-n4c5ccc(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)cc5c5c6ccccc6ccc54)c3)c2)c1.
What is the InChIKey of 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole?
The InChIKey is SJTDNJDNJXGCLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H43N/c1-40-33-41(2)35-48(34-40)44-17-13-16-43(36-44)45-18-14-23-51(37-45)62-58-31-29-46(38-55(58)60-52-24-10-9-15-42(52)28-32-59(60)62)47-27-30-54-53-25-11-12-26-56(53)61(57(54)39-47,49-19-5-3-6-20-49)50-21-7-4-8-22-50/h3-39H,1-2H3.
What are the key properties of 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole?
7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole has a molecular weight of 790.02 g/mol, XLogP of 15.92, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-10-(9,9-diphenylfluoren-2-yl)benzo[c]carbazole is sourced from PubChem (CID 134370705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).