3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole

C44H28N6 — CID 118699073

IUPAC3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7[nH]c8ccccc8c7c6)ccc54)c3)nc(-c3ccccn3)n2)cc1
InChIInChI=1S/C44H28N6/c1-2-11-28(12-3-1)42-47-43(49-44(48-42)39-18-8-9-24-45-39)31-13-10-14-32(25-31)50-40-19-7-5-16-34(40)36-27-30(21-23-41(36)50)29-20-22-38-35(26-29)33-15-4-6-17-37(33)46-38/h1-27,46H
InChIKeyAVYNZUWZZPRBST-UHFFFAOYSA-N
MW640.75 g/mol
LogP10.67
Rot. Bonds5

About 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole

3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole (PubChem CID 118699073) has the molecular formula C44H28N6 and a molecular weight of 640.75 g/mol. Its IUPAC name is 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
PubChem CID118699073
Molecular FormulaC44H28N6
Molecular Weight640.75 g/mol
Exact Mass640.24
IUPAC Name3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7[nH]c8ccccc8c7c6)ccc54)c3)nc(-c3ccccn3)n2)cc1
InChIInChI=1S/C44H28N6/c1-2-11-28(12-3-1)42-47-43(49-44(48-42)39-18-8-9-24-45-39)31-13-10-14-32(25-31)50-40-19-7-5-16-34(40)36-27-30(21-23-41(36)50)29-20-22-38-35(26-29)33-15-4-6-17-37(33)46-38/h1-27,46H
InChIKeyAVYNZUWZZPRBST-UHFFFAOYSA-N
XLogP10.67
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500640.75
LogP ≤ 510.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole 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

3-(9H-carbazol-3-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-5-yl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-5-yl]-3-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-5-yl]carbazol-3-yl]carbazole
CID 160627563
9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]carbazole
CID 58511626
3-(9H-carbazol-3-yl)-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrazin-2-yl]carbazole;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrazin-2-yl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-[9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrazin-2-yl]carbazol-3-yl]-9-phenylcarbazole;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrazin-2-yl]-3-[9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrazin-2-yl]carbazol-3-yl]carbazole
CID 160768811
3-(9H-carbazol-3-yl)-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-[9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-3-yl]-9-phenylcarbazole
CID 160628676
3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 158317836
3-(3-carbazol-9-ylphenyl)-6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole
CID 58943700
3-phenyl-9-[3-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 174243912
3-[3-[4,6-bis(4-pyridin-2-ylphenyl)pyrimidin-2-yl]phenyl]-9-(3-carbazol-9-ylphenyl)carbazole
CID 90209024
3-(9H-carbazol-3-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole;3-[9-[4-(2,6-diphenylpyrimidin-4-yl)-2-pyridinyl]carbazol-3-yl]-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazole
CID 159023455
3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 90211376
5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(9-phenylcarbazol-3-yl)pyrido[3,2-b]indole
CID 118587602
3,6-bis(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 118699027

Frequently Asked Questions

What is the IUPAC name of 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
The IUPAC name of 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole (CID 118699073) is 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole.
What is the SMILES notation for 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
The canonical SMILES for 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole is c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7[nH]c8ccccc8c7c6)ccc54)c3)nc(-c3ccccn3)n2)cc1.
What is the InChIKey of 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
The InChIKey is AVYNZUWZZPRBST-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N6/c1-2-11-28(12-3-1)42-47-43(49-44(48-42)39-18-8-9-24-45-39)31-13-10-14-32(25-31)50-40-19-7-5-16-34(40)36-27-30(21-23-41(36)50)29-20-22-38-35(26-29)33-15-4-6-17-37(33)46-38/h1-27,46H.
What are the key properties of 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole has a molecular weight of 640.75 g/mol, XLogP of 10.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole is sourced from PubChem (CID 118699073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).