9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole

C48H30N2O — CID 118565554

IUPAC9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)oc4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc45)ccc32)cc1
InChIInChI=1S/C48H30N2O/c1-3-11-35(12-4-1)49-43-17-9-7-15-37(43)41-27-31(21-25-45(41)49)33-19-23-39-40-24-20-34(30-48(40)51-47(39)29-33)32-22-26-46-42(28-32)38-16-8-10-18-44(38)50(46)36-13-5-2-6-14-36/h1-30H
InChIKeyNEDJSFMUALWDDY-UHFFFAOYSA-N
MW650.78 g/mol
LogP13.11
Rot. Bonds4

About 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole

9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole (PubChem CID 118565554) has the molecular formula C48H30N2O and a molecular weight of 650.78 g/mol. Its IUPAC name is 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole.

Molecular Properties

Compound Name9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole
PubChem CID118565554
Molecular FormulaC48H30N2O
Molecular Weight650.78 g/mol
Exact Mass650.24
IUPAC Name9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)oc4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc45)ccc32)cc1
InChIInChI=1S/C48H30N2O/c1-3-11-35(12-4-1)49-43-17-9-7-15-37(43)41-27-31(21-25-45(41)49)33-19-23-39-40-24-20-34(30-48(40)51-47(39)29-33)32-22-26-46-42(28-32)38-16-8-10-18-44(38)50(46)36-13-5-2-6-14-36/h1-30H
InChIKeyNEDJSFMUALWDDY-UHFFFAOYSA-N
XLogP13.11
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.78
LogP ≤ 513.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,9-diphenyl-6-[7-(9-phenylcarbazol-2-yl)dibenzofuran-3-yl]carbazole
CID 118565399
3-dibenzofuran-3-yl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 129065102
3,6-bis(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594553
10-[3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazol-9-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene
CID 118186402
3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-phenylcarbazole
CID 70658931
3-[7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-3-yl]-9-phenylcarbazole
CID 146702712
3-(8,15-dioxatetracyclo[14.4.0.02,7.09,14]icosa-1(20),2(7),3,5,9,11,13,16,18-nonaen-4-yl)-9-phenylcarbazole
CID 145223329
3-[9-(10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaen-7-yl)carbazol-3-yl]-9-phenylcarbazole
CID 142497222
9-phenyl-3-[3-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]phenyl]carbazole
CID 166009381
3-[4-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)carbazole
CID 146187490
2-[9-[4-[4-(4-dibenzofuran-3-ylphenyl)phenyl]phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 170386572
3-[7-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-9-phenylcarbazole
CID 158642418

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole?
The IUPAC name of 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole (CID 118565554) is 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole.
What is the SMILES notation for 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole?
The canonical SMILES for 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)oc4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc45)ccc32)cc1.
What is the InChIKey of 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole?
The InChIKey is NEDJSFMUALWDDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O/c1-3-11-35(12-4-1)49-43-17-9-7-15-37(43)41-27-31(21-25-45(41)49)33-19-23-39-40-24-20-34(30-48(40)51-47(39)29-33)32-22-26-46-42(28-32)38-16-8-10-18-44(38)50(46)36-13-5-2-6-14-36/h1-30H.
What are the key properties of 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole?
9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole has a molecular weight of 650.78 g/mol, XLogP of 13.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole is sourced from PubChem (CID 118565554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).