8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid

C19H15N3O4 — CID 68707895

IUPAC8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
SMILESCOc1cc2c(cc1C(=O)O)[nH]c(=O)c1c(C)nc(-c3ccccc3)n12
InChIInChI=1S/C19H15N3O4/c1-10-16-18(23)21-13-8-12(19(24)25)15(26-2)9-14(13)22(16)17(20-10)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,21,23)(H,24,25)
InChIKeyHILZKQGYYWTEHM-UHFFFAOYSA-N
MW349.35 g/mol
LogP2.86
Rot. Bonds3

About 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid

8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid (PubChem CID 68707895) has the molecular formula C19H15N3O4 and a molecular weight of 349.35 g/mol. Its IUPAC name is 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid.

Molecular Properties

Compound Name8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
PubChem CID68707895
Molecular FormulaC19H15N3O4
Molecular Weight349.35 g/mol
Exact Mass349.11
IUPAC Name8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
SMILESCOc1cc2c(cc1C(=O)O)[nH]c(=O)c1c(C)nc(-c3ccccc3)n12
InChIInChI=1S/C19H15N3O4/c1-10-16-18(23)21-13-8-12(19(24)25)15(26-2)9-14(13)22(16)17(20-10)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,21,23)(H,24,25)
InChIKeyHILZKQGYYWTEHM-UHFFFAOYSA-N
XLogP2.86
TPSA96.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.35
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6,7-dimethoxy-2-oxo-1H-quinoline-3-carboxylic acid
CID 22649364
8-chloro-7-(4-methylpiperazine-1-carbonyl)-1-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one
CID 68709047
5-fluoro-2-methoxy-4-phenylbenzoic acid
CID 170991634
6-methoxy-2-phenyl-1,3-benzothiazole-5-carboxylic acid
CID 67851580
1-cyclohexyl-7-(1,3-dihydroisoindole-2-carbonyl)-8-methoxy-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575157
2-methoxy-5-(2-phenyl-1,3-thiazol-4-yl)benzoic acid
CID 18707150
6,7-dimethoxy-1-methyl-4-phenylquinazolin-2-one
CID 158002363
6-methoxy-5-methyl-3-phenyl-1H-pyrazin-2-one
CID 10536676
8-chloro-N-(2-hydroxyethyl)-N-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxamide
CID 68702977
ethane;6-hydroxy-3-methoxy-7-phenyl-1H-quinolin-2-one
CID 144625825
8-methoxy-2-oxo-1H-quinoline-3-carboxylic acid
CID 22690286
2-methoxy-5-(4,5,6-trimethylpyrimidin-2-yl)benzoic acid
CID 162638294

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
The IUPAC name of 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid (CID 68707895) is 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid.
What is the SMILES notation for 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
The canonical SMILES for 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid is COc1cc2c(cc1C(=O)O)[nH]c(=O)c1c(C)nc(-c3ccccc3)n12.
What is the InChIKey of 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
The InChIKey is HILZKQGYYWTEHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O4/c1-10-16-18(23)21-13-8-12(19(24)25)15(26-2)9-14(13)22(16)17(20-10)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,21,23)(H,24,25).
What are the key properties of 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid has a molecular weight of 349.35 g/mol, XLogP of 2.86, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-3-methyl-4-oxo-1-phenyl-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid is sourced from PubChem (CID 68707895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).