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Aronixil

HCID 170355
NotesReactions

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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
86627-15-8
Standard SMILES
Cc1cccc(Nc2cc(Cl)nc(NCC(=O)O)n2)c1C
InChIKey
PNAYGNCLPYBJAL-UHFFFAOYSA-N
Molecular formula
C14H15ClN4O2
Average molar mass
306.75 g/mol
Monoisotopic mass
306.0883534

Overview

Aronixil is a small molecule drug. Aronixil has a monoisotopic molecular weight of 306.09 Da.

Names & identifiers

Preferred name
Aronixil
IUPAC
2-[[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]amino]acetic acid
English name
Aronixil
Molecular formula
C14H15ClN4O2
Molecular weight
0

Names & synonyms

Aronixil86627-15-8Aronixil [INN]AronixilumUNII-I5UTM533IPI5UTM533IPN-(4-Chloro-6-(2,3-xylidino)-2-pyrimidinyl)glycineN-(4-Chlor-6-(2,3-xylidino)-2-pyrimidinyl)glycinRefChem:1141592-[[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]amino]acetic acidAronixiloCHEMBL40357
Show more names
N-[4-Chloro-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]glycine
orb1698336SCHEMBL2732727PNAYGNCLPYBJAL-UHFFFAOYSA-NDTXSID601006958AKOS040750575NS00124417T30138Q27280482

Database identifiers

CAS
86627-15-8
PubChem CID
170355
DTXSID
DTXSID601006958
ChEMBL
CHEMBL40357
UNII
I5UTM533IP
Nikkaji
J25.823G

Properties

Computed structural propertiesFilling in

XLogP
3.7
Topological polar surface area
87.1 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
358

Physicochemical properties

FDA UNII
5 UTM533IP · I5UTM533IP

Chemistry & industry

Applications

UsesPharmaceutic aid (vehicle, flavored); pharmaceutic aid (vehicle, sweetened).

Suppliers2 total

TargetMol中国(陶术生物)15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]

Related reactions

2 records
New reaction record
HRID 637933 reaction equation
HRID 637933As productuspto-grants-1985_12
HRID 822279 reaction equation
HRID 822279As productTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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