2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole

C53H32N4O — CID 164736740

IUPAC2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)nc(-c3cccc4c(-c5cccc6oc7c8ccccc8ccc7c56)cccc34)n2)cc1
InChIInChI=1S/C53H32N4O/c1-3-15-34(16-4-1)51-54-52(35-29-30-42-41-20-9-10-26-46(41)57(47(42)32-35)36-17-5-2-6-18-36)56-53(55-51)44-25-12-21-38-39(22-11-23-40(38)44)43-24-13-27-48-49(43)45-31-28-33-14-7-8-19-37(33)50(45)58-48/h1-32H
InChIKeyRMGINNYDJIWQJJ-UHFFFAOYSA-N
MW740.87 g/mol
LogP13.84
Rot. Bonds5

About 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole

2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole (PubChem CID 164736740) has the molecular formula C53H32N4O and a molecular weight of 740.87 g/mol. Its IUPAC name is 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
PubChem CID164736740
Molecular FormulaC53H32N4O
Molecular Weight740.87 g/mol
Exact Mass740.26
IUPAC Name2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)nc(-c3cccc4c(-c5cccc6oc7c8ccccc8ccc7c56)cccc34)n2)cc1
InChIInChI=1S/C53H32N4O/c1-3-15-34(16-4-1)51-54-52(35-29-30-42-41-20-9-10-26-46(41)57(47(42)32-35)36-17-5-2-6-18-36)56-53(55-51)44-25-12-21-38-39(22-11-23-40(38)44)43-24-13-27-48-49(43)45-31-28-33-14-7-8-19-37(33)50(45)58-48/h1-32H
InChIKeyRMGINNYDJIWQJJ-UHFFFAOYSA-N
XLogP13.84
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.87
LogP ≤ 513.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole 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-(4-naphtho[2,3-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 161127098
9-[4-(9-naphthalen-1-yldibenzofuran-4-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 166952374
2-[6-(4-dibenzofuran-4-yl-6-naphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]-9-phenylcarbazole
CID 139342501
5-[2-naphtho[1,2-b][1]benzofuran-7-yl-4-[4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 155474711
2-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-9-phenylcarbazole
CID 139342513
9-phenyl-2-[6-[4-phenyl-6-(9-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole
CID 155477559
9-[4-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylcarbazole
CID 174245138
2-[4-dibenzofuran-1-yl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 171445377
2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole
CID 137496780
4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-2-(9-phenylcarbazol-2-yl)-[1]benzofuro[3,2-d]pyrimidine
CID 142592796
9-[4-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 155049823
5-[4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]dibenzofuran-3-yl]phenyl]benzo[b]carbazole
CID 170253427

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole?
The IUPAC name of 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole (CID 164736740) is 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole.
What is the SMILES notation for 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole?
The canonical SMILES for 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole is c1ccc(-c2nc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)nc(-c3cccc4c(-c5cccc6oc7c8ccccc8ccc7c56)cccc34)n2)cc1.
What is the InChIKey of 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole?
The InChIKey is RMGINNYDJIWQJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H32N4O/c1-3-15-34(16-4-1)51-54-52(35-29-30-42-41-20-9-10-26-46(41)57(47(42)32-35)36-17-5-2-6-18-36)56-53(55-51)44-25-12-21-38-39(22-11-23-40(38)44)43-24-13-27-48-49(43)45-31-28-33-14-7-8-19-37(33)50(45)58-48/h1-32H.
What are the key properties of 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole?
2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole has a molecular weight of 740.87 g/mol, XLogP of 13.84, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-naphtho[1,2-b][1]benzofuran-7-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole is sourced from PubChem (CID 164736740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).