3-(2,4-Dichloro-pyrimidin-5-yl)-2-(3,5-dimethoxy-phenyl)-propionic acid methyl ester

HCID 21044320
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Basic information

Standard SMILES
COC(=O)C(Cc1cnc(Cl)nc1Cl)c1cc(OC)cc(OC)c1
InChIKey
BNSNEYFSBZJQHZ-UHFFFAOYSA-N
Molecular formula
C16H16Cl2N2O4
Average molar mass
371.2 g/mol

Names & identifiers

Preferred name
3-(2,4-Dichloro-pyrimidin-5-yl)-2-(3,5-dimethoxy-phenyl)-propionic acid methyl ester
IUPAC
methyl 3-(2,4-dichloropyrimidin-5-yl)-2-(3,5-dimethoxyphenyl)propanoate

Names & synonyms

SCHEMBL4770069BNSNEYFSBZJQHZ-UHFFFAOYSA-N3-(2,4-dichloro-pyrimidin-5-yl)-2-(3,5-dimethoxy-phenyl)-propionic acid methyl ester

Database identifiers

PubChem CID
21044320

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
70.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
24

Related reactions

3 records
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Compound notes

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