3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione

C18H10N2O3 — CID 927711

IUPAC3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione
SMILESO=C1c2ccccc2C(=O)c2[nH]c(=O)c(-c3ccccc3)nc21
InChIInChI=1S/C18H10N2O3/c21-16-11-8-4-5-9-12(11)17(22)15-14(16)19-13(18(23)20-15)10-6-2-1-3-7-10/h1-9H,(H,20,23)
InChIKeyJGIYRACXBRPHAP-UHFFFAOYSA-N
MW302.29 g/mol
LogP2.21
Rot. Bonds1

About 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione

3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione (PubChem CID 927711) has the molecular formula C18H10N2O3 and a molecular weight of 302.29 g/mol. Its IUPAC name is 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione.

Molecular Properties

Compound Name3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione
PubChem CID927711
Molecular FormulaC18H10N2O3
Molecular Weight302.29 g/mol
Exact Mass302.07
IUPAC Name3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione
SMILESO=C1c2ccccc2C(=O)c2[nH]c(=O)c(-c3ccccc3)nc21
InChIInChI=1S/C18H10N2O3/c21-16-11-8-4-5-9-12(11)17(22)15-14(16)19-13(18(23)20-15)10-6-2-1-3-7-10/h1-9H,(H,20,23)
InChIKeyJGIYRACXBRPHAP-UHFFFAOYSA-N
XLogP2.21
TPSA79.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.29
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

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Related Compounds

1,4-dihydrobenzo[g]quinoxaline-2,3,5,10-tetrone
CID 121014847
2-(3-methylphenyl)-1H-benzo[f]benzimidazole-4,9-dione
CID 122368189
5-bromo-6-methyl-3-phenyl-1H-pyrazin-2-one
CID 165356399
5-phenylindeno[1,2-c]isoquinolin-11-one
CID 154625535
6-methoxy-5-methyl-3-phenyl-1H-pyrazin-2-one
CID 10536676
6-bromo-2-phenyl-4H-pyrido[2,3-b]pyrazin-3-one
CID 177349463
2,3,5-triphenyl-6-[4-(3,5,6-triphenylpyrazin-2-yl)phenyl]pyrazine
CID 139681938
3-(4-chlorophenyl)-2-(4-methylphenyl)benzo[g]quinoxaline-5,10-dione
CID 138484311
2-[4-(1,3,2-dioxaborinan-2-yl)phenyl]-1H-benzo[f]benzimidazole-4,9-dione
CID 42646419
2,3-bis(sulfanylidene)-1,4-dihydrobenzo[g]quinoxaline-5,10-dione
CID 15817926
5-bromo-3-phenyl-1H-pyrazin-2-one
CID 20528924
3-methyl-1H-benzo[g]quinoline-2,5,10-trione
CID 10130968

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione?
The IUPAC name of 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione (CID 927711) is 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione.
What is the SMILES notation for 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione?
The canonical SMILES for 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione is O=C1c2ccccc2C(=O)c2[nH]c(=O)c(-c3ccccc3)nc21.
What is the InChIKey of 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione?
The InChIKey is JGIYRACXBRPHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10N2O3/c21-16-11-8-4-5-9-12(11)17(22)15-14(16)19-13(18(23)20-15)10-6-2-1-3-7-10/h1-9H,(H,20,23).
What are the key properties of 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione?
3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione has a molecular weight of 302.29 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1H-benzo[g]quinoxaline-2,5,10-trione is sourced from PubChem (CID 927711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).