2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole

C52H32N2O — CID 126753463

IUPAC2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc7cc(-c8ccc9c(c8)oc8ccccc89)ccc7c6)c5c4)cc32)cc1
InChIInChI=1S/C52H32N2O/c1-2-10-39(11-3-1)53-47-15-7-4-12-41(47)43-25-21-36(30-49(43)53)37-22-26-44-42-13-5-8-16-48(42)54(50(44)31-37)40-24-20-34-28-33(18-19-35(34)29-40)38-23-27-46-45-14-6-9-17-51(45)55-52(46)32-38/h1-32H
InChIKeySGTORLJQTARFFF-UHFFFAOYSA-N
MW700.84 g/mol
LogP14.27
Rot. Bonds4

About 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole

2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole (PubChem CID 126753463) has the molecular formula C52H32N2O and a molecular weight of 700.84 g/mol. Its IUPAC name is 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole
PubChem CID126753463
Molecular FormulaC52H32N2O
Molecular Weight700.84 g/mol
Exact Mass700.25
IUPAC Name2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc7cc(-c8ccc9c(c8)oc8ccccc89)ccc7c6)c5c4)cc32)cc1
InChIInChI=1S/C52H32N2O/c1-2-10-39(11-3-1)53-47-15-7-4-12-41(47)43-25-21-36(30-49(43)53)37-22-26-44-42-13-5-8-16-48(42)54(50(44)31-37)40-24-20-34-28-33(18-19-35(34)29-40)38-23-27-46-45-14-6-9-17-51(45)55-52(46)32-38/h1-32H
InChIKeySGTORLJQTARFFF-UHFFFAOYSA-N
XLogP14.27
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500700.84
LogP ≤ 514.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[9-[4-[4-(4-dibenzofuran-3-ylphenyl)phenyl]phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 170386572
3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-phenylcarbazole
CID 70658931
2-[9-(6-dibenzofuran-1-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole
CID 126753215
2-dibenzofuran-3-yl-9-[6-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]naphthalen-2-yl]carbazole
CID 126631880
2-[7-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-9-phenylcarbazole
CID 139342798
3-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(6-dibenzofuran-4-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 161417407
6-[3-dibenzofuran-3-yl-5-(9-phenylcarbazol-2-yl)phenyl]-N,N-diphenylnaphthalen-2-amine
CID 121443751
3,6-bis(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594553
3-[9-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)carbazol-2-yl]-9-phenylcarbazole
CID 135171606
2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126631881
2-dibenzofuran-3-yl-9-[4-[4-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-6-[4-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 126631913
2,6-bis(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594589

Frequently Asked Questions

What is the IUPAC name of 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole?
The IUPAC name of 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole (CID 126753463) is 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole.
What is the SMILES notation for 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole?
The canonical SMILES for 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc7cc(-c8ccc9c(c8)oc8ccccc89)ccc7c6)c5c4)cc32)cc1.
What is the InChIKey of 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole?
The InChIKey is SGTORLJQTARFFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N2O/c1-2-10-39(11-3-1)53-47-15-7-4-12-41(47)43-25-21-36(30-49(43)53)37-22-26-44-42-13-5-8-16-48(42)54(50(44)31-37)40-24-20-34-28-33(18-19-35(34)29-40)38-23-27-46-45-14-6-9-17-51(45)55-52(46)32-38/h1-32H.
What are the key properties of 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole?
2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole has a molecular weight of 700.84 g/mol, XLogP of 14.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole is sourced from PubChem (CID 126753463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).