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Dimethylamino 2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoate

HCID 19090490
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Basic information

Standard SMILES
COc1cc(OC)nc(Oc2cccc(Cl)c2C(=O)ON(C)C)n1
InChIKey
NCVDJOJJPATADT-UHFFFAOYSA-N
Molecular formula
C15H16ClN3O5
Average molar mass
353.76 g/mol

Names & identifiers

Preferred name
Dimethylamino 2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoate
IUPAC
dimethylamino 2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)oxybenzoate

Names & synonyms

SCHEMBL9046476

Database identifiers

PubChem CID
19090490

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
83 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
24
Formal charge
0
Complexity
403

Related reactions

1 records
New reaction record
HRID 1568604 reaction equation
HRID 1568604As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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