9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole

C52H34N2O — CID 71127207

IUPAC9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole
SMILESc1ccc(-n2c3ccccc3c3cccc(-c4cccc(-c5ccc(-c6cccc(-c7cccc8c9ccccc9n(-c9ccccc9)c78)c6)o5)c4)c32)cc1
InChIInChI=1S/C52H34N2O/c1-3-19-39(20-4-1)53-47-29-9-7-23-43(47)45-27-13-25-41(51(45)53)35-15-11-17-37(33-35)49-31-32-50(55-49)38-18-12-16-36(34-38)42-26-14-28-46-44-24-8-10-30-48(44)54(52(42)46)40-21-5-2-6-22-40/h1-34H
InChIKeyQMQWILYVLLAXLD-UHFFFAOYSA-N
MW702.86 g/mol
LogP14.14
Rot. Bonds6

About 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole

9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole (PubChem CID 71127207) has the molecular formula C52H34N2O and a molecular weight of 702.86 g/mol. Its IUPAC name is 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole
PubChem CID71127207
Molecular FormulaC52H34N2O
Molecular Weight702.86 g/mol
Exact Mass702.27
IUPAC Name9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole
SMILESc1ccc(-n2c3ccccc3c3cccc(-c4cccc(-c5ccc(-c6cccc(-c7cccc8c9ccccc9n(-c9ccccc9)c78)c6)o5)c4)c32)cc1
InChIInChI=1S/C52H34N2O/c1-3-19-39(20-4-1)53-47-29-9-7-23-43(47)45-27-13-25-41(51(45)53)35-15-11-17-37(33-35)49-31-32-50(55-49)38-18-12-16-36(34-38)42-26-14-28-46-44-24-8-10-30-48(44)54(52(42)46)40-21-5-2-6-22-40/h1-34H
InChIKeyQMQWILYVLLAXLD-UHFFFAOYSA-N
XLogP14.14
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500702.86
LogP ≤ 514.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-phenyl-1-[3-[3-phenyl-5-(9-phenylcarbazol-1-yl)phenyl]phenyl]carbazole
CID 71127197
9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole
CID 118014216
9-phenyl-1-[2-(3-phenylphenyl)phenyl]carbazole
CID 175012916
1-dibenzofuran-3-yl-9-phenylcarbazole
CID 137466533
1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole
CID 137466576
1-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 154590389
1-(3-methyl-4-phenylphenyl)-9-phenylcarbazole
CID 146397471
6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-3-yl)carbazole
CID 126630373
1-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-[4-(9-phenylcarbazol-1-yl)phenyl]carbazole
CID 118149455
1-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9-phenylcarbazole
CID 129312013
1-(3,5-dimethylphenyl)-9-phenylcarbazole
CID 169054866
3-[9-(3,5-diphenylphenyl)carbazol-1-yl]-9-(4-phenylphenyl)carbazole;3-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole;9-(3-phenylphenyl)-1-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159712744

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole?
The IUPAC name of 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole (CID 71127207) is 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole.
What is the SMILES notation for 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole?
The canonical SMILES for 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole is c1ccc(-n2c3ccccc3c3cccc(-c4cccc(-c5ccc(-c6cccc(-c7cccc8c9ccccc9n(-c9ccccc9)c78)c6)o5)c4)c32)cc1.
What is the InChIKey of 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole?
The InChIKey is QMQWILYVLLAXLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34N2O/c1-3-19-39(20-4-1)53-47-29-9-7-23-43(47)45-27-13-25-41(51(45)53)35-15-11-17-37(33-35)49-31-32-50(55-49)38-18-12-16-36(34-38)42-26-14-28-46-44-24-8-10-30-48(44)54(52(42)46)40-21-5-2-6-22-40/h1-34H.
What are the key properties of 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole?
9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole has a molecular weight of 702.86 g/mol, XLogP of 14.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole is sourced from PubChem (CID 71127207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).