2-[2-(3-chloro-phenyl)-ethoxymethyl]-6-ethyl-3H-pyrido[2,3-d]pyrimidin-4-one
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Basic information
- Standard SMILES
CCc1cnc2nc(COCCc3cccc(Cl)c3)[nH]c(=O)c2c1- InChIKey
XDJOFFMZAOVEKN-UHFFFAOYSA-N- Molecular formula
- C18H18ClN3O2
- Average molar mass
- 343.8 g/mol
Names & identifiers
- Preferred name
- 2-[2-(3-chloro-phenyl)-ethoxymethyl]-6-ethyl-3H-pyrido[2,3-d]pyrimidin-4-one
- IUPAC
- 2-[2-(3-chlorophenyl)ethoxymethyl]-6-ethyl-3H-pyrido[2,3-d]pyrimidin-4-one
Names & synonyms
SCHEMBL1875679XDJOFFMZAOVEKN-UHFFFAOYSA-N2-[2-(3-chloro-phenyl)-ethoxymethyl]-6-ethyl-3H-pyrido[2,3-d]pyrimidin-4-one
Database identifiers
- PubChem CID
- 136368399
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 471
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Related reactions
1 records
Compound notes
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