6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline

C20H12Cl2N2 — CID 132520838

IUPAC6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline
SMILESClc1ccc(-c2nc3cc(Cl)ccc3nc2-c2ccccc2)cc1
InChIInChI=1S/C20H12Cl2N2/c21-15-8-6-14(7-9-15)20-19(13-4-2-1-3-5-13)23-17-11-10-16(22)12-18(17)24-20/h1-12H
InChIKeyYWWBHMDUHSOCKD-UHFFFAOYSA-N
MW351.24 g/mol
LogP6.27
Rot. Bonds2

About 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline

6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline (PubChem CID 132520838) has the molecular formula C20H12Cl2N2 and a molecular weight of 351.24 g/mol. Its IUPAC name is 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline.

Molecular Properties

Compound Name6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline
PubChem CID132520838
Molecular FormulaC20H12Cl2N2
Molecular Weight351.24 g/mol
Exact Mass350.04
IUPAC Name6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline
SMILESClc1ccc(-c2nc3cc(Cl)ccc3nc2-c2ccccc2)cc1
InChIInChI=1S/C20H12Cl2N2/c21-15-8-6-14(7-9-15)20-19(13-4-2-1-3-5-13)23-17-11-10-16(22)12-18(17)24-20/h1-12H
InChIKeyYWWBHMDUHSOCKD-UHFFFAOYSA-N
XLogP6.27
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.24
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,7-bis(4-chlorophenyl)-2,8-diphenylpyrazino[2,3-g]quinoxaline
CID 21026465
4-(7-chloro-3-phenylquinoxalin-2-yl)phenol
CID 136805911
6-chloro-2-(4-methoxyphenyl)-3-phenylquinoxaline
CID 118726434
(6-chloro-3-phenylquinoxalin-2-yl)hydrazine
CID 141464003
3-[3-(3-carboxyphenyl)-6-chloroquinoxalin-2-yl]benzoic acid
CID 139724557
2-chloro-3-(4-chlorophenyl)-5,6-diphenylpyrazine
CID 155576945
6-fluoro-2,3-diphenylquinoxaline
CID 3700648
2-[4-(6,7-dimethyl-3-phenylquinoxalin-2-yl)phenyl]-6,7-dimethyl-3-phenylquinoxaline
CID 58299261
6-[(2,3-diphenylquinoxalin-6-yl)methyl]-2,3-diphenylquinoxaline
CID 3106562
7-chloro-1-methyl-3-phenylquinoxalin-2-one
CID 163364599
7-chloro-2-phenylquinoxaline
CID 12631823
2-(5-chloro-2-fluorophenyl)-3-(4-fluorophenyl)quinoxaline
CID 123994326

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline?
The IUPAC name of 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline (CID 132520838) is 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline.
What is the SMILES notation for 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline?
The canonical SMILES for 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline is Clc1ccc(-c2nc3cc(Cl)ccc3nc2-c2ccccc2)cc1.
What is the InChIKey of 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline?
The InChIKey is YWWBHMDUHSOCKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12Cl2N2/c21-15-8-6-14(7-9-15)20-19(13-4-2-1-3-5-13)23-17-11-10-16(22)12-18(17)24-20/h1-12H.
What are the key properties of 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline?
6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline has a molecular weight of 351.24 g/mol, XLogP of 6.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(4-chlorophenyl)-2-phenylquinoxaline is sourced from PubChem (CID 132520838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).