6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]

C65H42N2 — CID 171053590

IUPAC6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4c-5c(-c5ccccc5)n(-c5ccccc5)c4-c4ccccc4)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C65H42N2/c1-6-20-43(21-7-1)46-35-38-59-54(40-46)55-41-47(36-39-60(55)66(59)49-26-12-4-13-27-49)48-34-37-53-58(42-48)65(56-32-18-16-30-51(56)52-31-17-19-33-57(52)65)62-61(53)63(44-22-8-2-9-23-44)67(50-28-14-5-15-29-50)64(62)45-24-10-3-11-25-45/h1-42H
InChIKeyGQUQFFIGVZTGGH-UHFFFAOYSA-N
MW851.07 g/mol
LogP16.59
Rot. Bonds6

About 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]

6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole] (PubChem CID 171053590) has the molecular formula C65H42N2 and a molecular weight of 851.07 g/mol. Its IUPAC name is 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole].

Molecular Properties

Compound Name6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]
PubChem CID171053590
Molecular FormulaC65H42N2
Molecular Weight851.07 g/mol
Exact Mass850.33
IUPAC Name6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4c-5c(-c5ccccc5)n(-c5ccccc5)c4-c4ccccc4)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C65H42N2/c1-6-20-43(21-7-1)46-35-38-59-54(40-46)55-41-47(36-39-60(55)66(59)49-26-12-4-13-27-49)48-34-37-53-58(42-48)65(56-32-18-16-30-51(56)52-31-17-19-33-57(52)65)62-61(53)63(44-22-8-2-9-23-44)67(50-28-14-5-15-29-50)64(62)45-24-10-3-11-25-45/h1-42H
InChIKeyGQUQFFIGVZTGGH-UHFFFAOYSA-N
XLogP16.59
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500851.07
LogP ≤ 516.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole] with MolForge

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

Launch Full Analysis

Related Compounds

9-phenyl-3-[4-[7'-[4-(9-phenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]carbazole
CID 59236537
9-[4-(10-phenylanthracen-9-yl)phenyl]-3-(9-phenylcarbazol-3-yl)-6-(9,9'-spirobi[fluorene]-2-yl)carbazole
CID 59306636
3,6-bis[4-[3,6-bis(9,9-diphenylfluoren-2-yl)carbazol-9-yl]phenyl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 59306581
3,6-bis(9,9-diphenylfluoren-2-yl)-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole
CID 59306967
9-phenyl-3-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylcarbazole
CID 129264521
9-phenyl-2-[3-(9-phenylcarbazol-3-yl)-5-(9,9'-spirobi[fluorene]-2-yl)phenyl]carbazole
CID 140922382
N-[4-(4-heptacyclo[11.10.1.11,8.02,7.017,24.018,23.012,25]pentacosa-2(7),3,5,8,10,12(25),13,15,17(24),18,20,22-dodecaenyl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 156664769
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009
3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118449222
8',11'-bis(3-phenylphenyl)spiro[fluorene-9,12'-indeno[2,1-a]carbazole]
CID 118331815
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-[4-[9,9-diphenyl-7-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-yl]phenyl]-9-phenylcarbazole
CID 89118693

Frequently Asked Questions

What is the IUPAC name of 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]?
The IUPAC name of 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole] (CID 171053590) is 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole].
What is the SMILES notation for 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]?
The canonical SMILES for 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole] is c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4c-5c(-c5ccccc5)n(-c5ccccc5)c4-c4ccccc4)ccc2n3-c2ccccc2)cc1.
What is the InChIKey of 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]?
The InChIKey is GQUQFFIGVZTGGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H42N2/c1-6-20-43(21-7-1)46-35-38-59-54(40-46)55-41-47(36-39-60(55)66(59)49-26-12-4-13-27-49)48-34-37-53-58(42-48)65(56-32-18-16-30-51(56)52-31-17-19-33-57(52)65)62-61(53)63(44-22-8-2-9-23-44)67(50-28-14-5-15-29-50)64(62)45-24-10-3-11-25-45/h1-42H.
What are the key properties of 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole]?
6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole] has a molecular weight of 851.07 g/mol, XLogP of 16.59, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6'-(6,9-diphenylcarbazol-3-yl)-1',2',3'-triphenylspiro[fluorene-9,4'-indeno[1,2-c]pyrrole] is sourced from PubChem (CID 171053590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).