4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid

C11H7BrN4O2 — CID 171487754

IUPAC4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid
SMILESNc1nc2ccc(C(=O)O)cc2n2c(Br)ncc12
InChIInChI=1S/C11H7BrN4O2/c12-11-14-4-8-9(13)15-6-2-1-5(10(17)18)3-7(6)16(8)11/h1-4H,(H2,13,15)(H,17,18)
InChIKeyHLUUOAWQZJXUPF-UHFFFAOYSA-N
MW307.11 g/mol
LogP1.93
Rot. Bonds1

About 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid

4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid (PubChem CID 171487754) has the molecular formula C11H7BrN4O2 and a molecular weight of 307.11 g/mol. Its IUPAC name is 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid.

Molecular Properties

Compound Name4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid
PubChem CID171487754
Molecular FormulaC11H7BrN4O2
Molecular Weight307.11 g/mol
Exact Mass305.98
IUPAC Name4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid
SMILESNc1nc2ccc(C(=O)O)cc2n2c(Br)ncc12
InChIInChI=1S/C11H7BrN4O2/c12-11-14-4-8-9(13)15-6-2-1-5(10(17)18)3-7(6)16(8)11/h1-4H,(H2,13,15)(H,17,18)
InChIKeyHLUUOAWQZJXUPF-UHFFFAOYSA-N
XLogP1.93
TPSA93.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.11
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid with MolForge

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

Launch Full Analysis

Related Compounds

2-amino-3-bromoquinoline-6-carboxylic acid
CID 156830315
2-amino-3-propylbenzimidazole-5-carboxylic acid
CID 84786648
2-amino-3-cyclopropylbenzimidazole-5-carboxylic acid
CID 84785186
3-(4-bromophenyl)-2-methylbenzimidazole-5-carboxylic acid
CID 82791461
2-amino-3-(2-methylpropyl)benzimidazole-5-carboxylic acid
CID 84796053
2-acetyl-3-methylbenzimidazole-5-carboxylic acid
CID 84622776
3-(3-bromo-4-chlorophenyl)-2-methylbenzimidazole-5-carboxylic acid
CID 82774779
2-ethyl-3-methylbenzimidazole-5-carboxylic acid
CID 53409133
imidazo[1,5-a]quinoxaline-8-carboxylic acid
CID 141205808
2-amino-3-cyclopropylquinoline-6-carboxylic acid
CID 171618620
3-hydroxy-2-phenylbenzimidazole-5-carboxylic acid
CID 10083635
4-chloro-1-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylic acid
CID 23380673

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid?
The IUPAC name of 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid (CID 171487754) is 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid.
What is the SMILES notation for 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid?
The canonical SMILES for 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid is Nc1nc2ccc(C(=O)O)cc2n2c(Br)ncc12.
What is the InChIKey of 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid?
The InChIKey is HLUUOAWQZJXUPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrN4O2/c12-11-14-4-8-9(13)15-6-2-1-5(10(17)18)3-7(6)16(8)11/h1-4H,(H2,13,15)(H,17,18).
What are the key properties of 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid?
4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid has a molecular weight of 307.11 g/mol, XLogP of 1.93, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-bromoimidazo[1,5-a]quinoxaline-8-carboxylic acid is sourced from PubChem (CID 171487754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).