1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline

C23H22N2O3 — CID 91417802

IUPAC1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline
SMILESCOc1ccc(C2=Nc3ccccc3N(OC)C2c2ccc(OC)cc2)cc1
InChIInChI=1S/C23H22N2O3/c1-26-18-12-8-16(9-13-18)22-23(17-10-14-19(27-2)15-11-17)25(28-3)21-7-5-4-6-20(21)24-22/h4-15,23H,1-3H3
InChIKeyXXVQZLNVRPGIJF-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.95
Rot. Bonds5

About 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline

1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline (PubChem CID 91417802) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline.

Molecular Properties

Compound Name1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline
PubChem CID91417802
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC Name1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline
SMILESCOc1ccc(C2=Nc3ccccc3N(OC)C2c2ccc(OC)cc2)cc1
InChIInChI=1S/C23H22N2O3/c1-26-18-12-8-16(9-13-18)22-23(17-10-14-19(27-2)15-11-17)25(28-3)21-7-5-4-6-20(21)24-22/h4-15,23H,1-3H3
InChIKeyXXVQZLNVRPGIJF-UHFFFAOYSA-N
XLogP4.95
TPSA43.29 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline?
The IUPAC name of 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline (CID 91417802) is 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline.
What is the SMILES notation for 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline?
The canonical SMILES for 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline is COc1ccc(C2=Nc3ccccc3N(OC)C2c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline?
The InChIKey is XXVQZLNVRPGIJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-26-18-12-8-16(9-13-18)22-23(17-10-14-19(27-2)15-11-17)25(28-3)21-7-5-4-6-20(21)24-22/h4-15,23H,1-3H3.
What are the key properties of 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline?
1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline has a molecular weight of 374.44 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2,3-bis(4-methoxyphenyl)-2H-quinoxaline is sourced from PubChem (CID 91417802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).