11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole

C75H47N — CID 138553243

IUPAC11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3cc4c(cc32)c2ccccc2n4-c2cccc(-c3c4ccccc4c(-c4ccc5c(c4)-c4ccccc4-c4ccccc4-c4ccccc4-5)c4ccccc34)c2)cc1
InChIInChI=1S/C75H47N/c1-3-23-50(24-4-1)75(51-25-5-2-6-26-51)69-40-19-17-34-60(69)67-47-72-68(46-70(67)75)61-35-18-20-41-71(61)76(72)52-27-21-22-48(44-52)73-62-36-13-15-38-64(62)74(65-39-16-14-37-63(65)73)49-42-43-59-57-32-10-9-30-55(57)53-28-7-8-29-54(53)56-31-11-12-33-58(56)66(59)45-49/h1-47H/b55-53-,56-54-,59-57-,66-58-
InChIKeyOFYACINGSVVJCS-LZRITJLHSA-N
MW962.21 g/mol
LogP19.77
Rot. Bonds5

About 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole

11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole (PubChem CID 138553243) has the molecular formula C75H47N and a molecular weight of 962.21 g/mol. Its IUPAC name is 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole.

Molecular Properties

Compound Name11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole
PubChem CID138553243
Molecular FormulaC75H47N
Molecular Weight962.21 g/mol
Exact Mass961.37
IUPAC Name11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3cc4c(cc32)c2ccccc2n4-c2cccc(-c3c4ccccc4c(-c4ccc5c(c4)-c4ccccc4-c4ccccc4-c4ccccc4-5)c4ccccc34)c2)cc1
InChIInChI=1S/C75H47N/c1-3-23-50(24-4-1)75(51-25-5-2-6-26-51)69-40-19-17-34-60(69)67-47-72-68(46-70(67)75)61-35-18-20-41-71(61)76(72)52-27-21-22-48(44-52)73-62-36-13-15-38-64(62)74(65-39-16-14-37-63(65)73)49-42-43-59-57-32-10-9-30-55(57)53-28-7-8-29-54(53)56-31-11-12-33-58(56)66(59)45-49/h1-47H/b55-53-,56-54-,59-57-,66-58-
InChIKeyOFYACINGSVVJCS-LZRITJLHSA-N
XLogP19.77
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500962.21
LogP ≤ 519.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

7,7-diphenyl-5-(3-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole;11,11-diphenyl-5-(3-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]indeno[1,2-b]carbazole
CID 161280871
7,7-diphenyl-5-(4-phenylphenyl)-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole;11,11-diphenyl-5-(4-phenylphenyl)-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[1,2-b]carbazole
CID 158074658
5-[4-(4-carbazol-9-ylphenyl)phenyl]-11,11-diphenylindeno[1,2-b]carbazole
CID 168783626
3,6-bis(9,9-diphenylfluoren-2-yl)-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole
CID 59306967
5-(3-indolo[1,2-a]quinoxalin-7-ylphenyl)-11,11-diphenylindeno[1,2-b]carbazole
CID 145180297
9-phenyl-3-(9-phenylfluoren-9-yl)-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 121311550
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
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
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
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-[4-[4-[3-[9-[3-(4-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590364

Frequently Asked Questions

What is the IUPAC name of 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole?
The IUPAC name of 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole (CID 138553243) is 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole.
What is the SMILES notation for 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole?
The canonical SMILES for 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole is c1ccc(C2(c3ccccc3)c3ccccc3-c3cc4c(cc32)c2ccccc2n4-c2cccc(-c3c4ccccc4c(-c4ccc5c(c4)-c4ccccc4-c4ccccc4-c4ccccc4-5)c4ccccc34)c2)cc1.
What is the InChIKey of 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole?
The InChIKey is OFYACINGSVVJCS-LZRITJLHSA-N. The full InChI is InChI=1S/C75H47N/c1-3-23-50(24-4-1)75(51-25-5-2-6-26-51)69-40-19-17-34-60(69)67-47-72-68(46-70(67)75)61-35-18-20-41-71(61)76(72)52-27-21-22-48(44-52)73-62-36-13-15-38-64(62)74(65-39-16-14-37-63(65)73)49-42-43-59-57-32-10-9-30-55(57)53-28-7-8-29-54(53)56-31-11-12-33-58(56)66(59)45-49/h1-47H/b55-53-,56-54-,59-57-,66-58-.
What are the key properties of 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole?
11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole has a molecular weight of 962.21 g/mol, XLogP of 19.77, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole is sourced from PubChem (CID 138553243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).