6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline

C20H17ClN4O — CID 165415106

IUPAC6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
SMILESCc1nc2cc(Cl)ccc2nc1OCc1nc(-c2ccccc2)cn1C
InChIInChI=1S/C20H17ClN4O/c1-13-20(24-16-9-8-15(21)10-17(16)22-13)26-12-19-23-18(11-25(19)2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeyZASWXIBPZNLNGZ-UHFFFAOYSA-N
MW364.84 g/mol
LogP4.57
Rot. Bonds4

About 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline

6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline (PubChem CID 165415106) has the molecular formula C20H17ClN4O and a molecular weight of 364.84 g/mol. Its IUPAC name is 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline.

Molecular Properties

Compound Name6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
PubChem CID165415106
Molecular FormulaC20H17ClN4O
Molecular Weight364.84 g/mol
Exact Mass364.11
IUPAC Name6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
SMILESCc1nc2cc(Cl)ccc2nc1OCc1nc(-c2ccccc2)cn1C
InChIInChI=1S/C20H17ClN4O/c1-13-20(24-16-9-8-15(21)10-17(16)22-13)26-12-19-23-18(11-25(19)2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeyZASWXIBPZNLNGZ-UHFFFAOYSA-N
XLogP4.57
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.84
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline?
The IUPAC name of 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline (CID 165415106) is 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline.
What is the SMILES notation for 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline?
The canonical SMILES for 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline is Cc1nc2cc(Cl)ccc2nc1OCc1nc(-c2ccccc2)cn1C.
What is the InChIKey of 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline?
The InChIKey is ZASWXIBPZNLNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O/c1-13-20(24-16-9-8-15(21)10-17(16)22-13)26-12-19-23-18(11-25(19)2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3.
What are the key properties of 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline?
6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline has a molecular weight of 364.84 g/mol, XLogP of 4.57, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline is sourced from PubChem (CID 165415106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).