2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline

C25H16ClN3 — CID 147700153

IUPAC2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline
SMILESClc1nc2ccccc2nc1-c1cc(-c2ccccc2)nc(-c2ccccc2)c1
InChIInChI=1S/C25H16ClN3/c26-25-24(28-20-13-7-8-14-21(20)29-25)19-15-22(17-9-3-1-4-10-17)27-23(16-19)18-11-5-2-6-12-18/h1-16H
InChIKeyGSRLUBSEUGMWCY-UHFFFAOYSA-N
MW393.88 g/mol
LogP6.68
Rot. Bonds3

About 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline

2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline (PubChem CID 147700153) has the molecular formula C25H16ClN3 and a molecular weight of 393.88 g/mol. Its IUPAC name is 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline.

Molecular Properties

Compound Name2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline
PubChem CID147700153
Molecular FormulaC25H16ClN3
Molecular Weight393.88 g/mol
Exact Mass393.10
IUPAC Name2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline
SMILESClc1nc2ccccc2nc1-c1cc(-c2ccccc2)nc(-c2ccccc2)c1
InChIInChI=1S/C25H16ClN3/c26-25-24(28-20-13-7-8-14-21(20)29-25)19-15-22(17-9-3-1-4-10-17)27-23(16-19)18-11-5-2-6-12-18/h1-16H
InChIKeyGSRLUBSEUGMWCY-UHFFFAOYSA-N
XLogP6.68
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.88
LogP ≤ 56.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline 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-[3-(3,5-diphenylphenyl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-diphenylpyridine
CID 154599724
2-phenyl-4,6-bis[3-phenyl-5-(4-phenylphenyl)phenyl]pyridine
CID 121311684
2,4-bis(4-chlorophenyl)-6-phenylpyridine
CID 3640020
4-[3-(2,6-diphenyl-4-pyridinyl)-5-phenylphenyl]-2,6-diphenylpyridine
CID 59428704
4-(2,6-dichlorophenyl)-2,6-diphenylpyridine
CID 139203314
4-[3,5-bis(4-phenylphenyl)phenyl]-2,6-diphenylpyridine
CID 58943272
2,4-diphenyl-6-[4-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]pyridine
CID 58943632
2-[4-[3-(3,5-diphenylphenyl)-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]-4,6-diphenylpyridine
CID 58943331
2,6-diphenyl-4-[3-(3-phenylphenyl)phenyl]pyridine
CID 58943255
4-(2,6-diphenyl-4-pyridinyl)phenol
CID 4640455
2,3-dichloro-6-phenylquinoxaline
CID 97036461
4-[3,5-bis(2,6-diphenyl-4-pyridinyl)phenyl]-2,6-bis(2-phenylphenyl)pyridine
CID 58693115

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline?
The IUPAC name of 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline (CID 147700153) is 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline.
What is the SMILES notation for 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline?
The canonical SMILES for 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline is Clc1nc2ccccc2nc1-c1cc(-c2ccccc2)nc(-c2ccccc2)c1.
What is the InChIKey of 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline?
The InChIKey is GSRLUBSEUGMWCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16ClN3/c26-25-24(28-20-13-7-8-14-21(20)29-25)19-15-22(17-9-3-1-4-10-17)27-23(16-19)18-11-5-2-6-12-18/h1-16H.
What are the key properties of 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline?
2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline has a molecular weight of 393.88 g/mol, XLogP of 6.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-(2,6-diphenyl-4-pyridinyl)quinoxaline is sourced from PubChem (CID 147700153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).