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6-(2,6-Dichlorophenyl)-2-(3,4-dimethoxyphenylamino)-8-ethyl-8H-pyrido[2,3-d]pyrimidin-7-one

HCID 11684253
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(OC)c(OC)c3)nc21
InChIKey
VWZREDSJCLGIMA-UHFFFAOYSA-N
Molecular formula
C23H20Cl2N4O3
Average molar mass
471.3 g/mol

Names & identifiers

Preferred name
6-(2,6-Dichlorophenyl)-2-(3,4-dimethoxyphenylamino)-8-ethyl-8H-pyrido[2,3-d]pyrimidin-7-one
IUPAC
6-(2,6-dichlorophenyl)-2-(3,4-dimethoxyanilino)-8-ethylpyrido[2,3-d]pyrimidin-7-one

Names & synonyms

SCHEMBL5760913VWZREDSJCLGIMA-UHFFFAOYSA-NDB-196752185039-86-56-(2,6-Dichlorophenyl)-2-(3,4-dimethoxyphenylamino)-8-ethyl-8H-pyrido[2,3-d]pyrimidin-7-one6-(2,6-Dichlorophenyl)-2-[(3,4-dimethoxyphenyl)amino]-8-ethyl-pyrido[2,3-d]pyrimidin-7(8h)-one

Database identifiers

PubChem CID
11684253

Properties

Computed structural propertiesFilling in

XLogP
5.2
Topological polar surface area
76.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
32
Formal charge
0
Complexity
686

Related reactions

2 records
New reaction record
HRID 3206 reaction equation
HRID 3206As productuspto-grants-1998_03
HRID 214623 reaction equation
HRID 214623As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

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