3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole

C46H28N2O — CID 70658967

IUPAC3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole
SMILESc1ccc2c(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc8c(c7)oc7ccccc78)c6c5)ccc43)cccc2c1
InChIInChI=1S/C46H28N2O/c1-2-12-33-29(10-1)11-9-18-40(33)48-42-17-7-4-14-35(42)39-26-30(21-25-43(39)48)31-20-23-36-34-13-3-6-16-41(34)47(44(36)27-31)32-22-24-38-37-15-5-8-19-45(37)49-46(38)28-32/h1-28H
InChIKeyMJWQGQSFLLWBPH-UHFFFAOYSA-N
MW624.74 g/mol
LogP12.60
Rot. Bonds3

About 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole

3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole (PubChem CID 70658967) has the molecular formula C46H28N2O and a molecular weight of 624.74 g/mol. Its IUPAC name is 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole.

Molecular Properties

Compound Name3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole
PubChem CID70658967
Molecular FormulaC46H28N2O
Molecular Weight624.74 g/mol
Exact Mass624.22
IUPAC Name3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole
SMILESc1ccc2c(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc8c(c7)oc7ccccc78)c6c5)ccc43)cccc2c1
InChIInChI=1S/C46H28N2O/c1-2-12-33-29(10-1)11-9-18-40(33)48-42-17-7-4-14-35(42)39-26-30(21-25-43(39)48)31-20-23-36-34-13-3-6-16-41(34)47(44(36)27-31)32-22-24-38-37-15-5-8-19-45(37)49-46(38)28-32/h1-28H
InChIKeyMJWQGQSFLLWBPH-UHFFFAOYSA-N
XLogP12.60
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500624.74
LogP ≤ 512.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole 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

2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-naphthalen-2-ylcarbazole;2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-(9-dibenzofuran-3-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 161318809
3-[9-(3-dibenzofuran-2-ylphenyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole
CID 155305806
3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-phenylcarbazole
CID 70658931
3-dibenzofuran-2-yl-9-dibenzofuran-3-ylcarbazole
CID 118504725
2-(9-naphthalen-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 142356851
3,6-bis(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594553
3-(7-bromodibenzofuran-2-yl)-9-naphthalen-1-ylcarbazole
CID 129180922
3-[4-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)carbazole
CID 146187490
12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)-[1]benzofuro[2,3-a]carbazole
CID 157381564
5-(9-dibenzofuran-3-ylcarbazol-3-yl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 122594946
3-[9-(6-dibenzofuran-1-ylnaphthalen-1-yl)carbazol-2-yl]-9-phenylcarbazole
CID 118534204
11-naphthalen-2-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)-[1]benzofuro[3,2-b]carbazole;5-naphthalen-2-yl-2-(9-naphthalen-1-ylcarbazol-3-yl)-[1]benzofuro[3,2-c]carbazole;14-naphthalen-2-yl-18-(9-naphthalen-1-ylcarbazol-3-yl)-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene
CID 159963365

Frequently Asked Questions

What is the IUPAC name of 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole?
The IUPAC name of 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole (CID 70658967) is 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole.
What is the SMILES notation for 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole?
The canonical SMILES for 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole is c1ccc2c(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc8c(c7)oc7ccccc78)c6c5)ccc43)cccc2c1.
What is the InChIKey of 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole?
The InChIKey is MJWQGQSFLLWBPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H28N2O/c1-2-12-33-29(10-1)11-9-18-40(33)48-42-17-7-4-14-35(42)39-26-30(21-25-43(39)48)31-20-23-36-34-13-3-6-16-41(34)47(44(36)27-31)32-22-24-38-37-15-5-8-19-45(37)49-46(38)28-32/h1-28H.
What are the key properties of 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole?
3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole has a molecular weight of 624.74 g/mol, XLogP of 12.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-naphthalen-1-ylcarbazole is sourced from PubChem (CID 70658967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).