(S)-2-(1H-indazol-5-yl)-3-(methyl(1-phenylethyl)amino)quinoxaline-6-carboxylic acid

HCID 60198537
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Basic information

Standard SMILES
C[C@@H](c1ccccc1)N(C)c1nc2cc(C(=O)O)ccc2nc1-c1ccc2[nH]ncc2c1
InChIKey
VKLQVNOXLJTORI-HNNXBMFYSA-N
Molecular formula
C25H21N5O2
Average molar mass
423.5 g/mol

Names & identifiers

Preferred name
(S)-2-(1H-indazol-5-yl)-3-(methyl(1-phenylethyl)amino)quinoxaline-6-carboxylic acid
IUPAC
2-(1H-indazol-5-yl)-3-[methyl-[(1S)-1-phenylethyl]amino]quinoxaline-6-carboxylic acid

Names & synonyms

CHEMBL3715631SCHEMBL12100698VKLQVNOXLJTORI-HNNXBMFYSA-N(S)-2-(1H-indazol-5-yl)-3-(methyl(1-phenylethyl)amino)quinoxaline-6-carboxylic acid

Database identifiers

PubChem CID
60198537
ChEMBL
CHEMBL3715631

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
95 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
32

Related reactions

1 records
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Compound notes

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