Basic information
- Standard SMILES
CC(C)Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(N)nc21- InChIKey
AQUXBIDNWAFZLO-UHFFFAOYSA-N- Molecular formula
- C17H16Cl2N4O
- Average molar mass
- 363.2 g/mol
Names & identifiers
- Preferred name
- 2-amino-6-(2,6-dichlorophenyl)-8-isobutyl-8H-pyrido[2,3-d]pyrimidin-7-one
- IUPAC
- 2-amino-6-(2,6-dichlorophenyl)-8-(2-methylpropyl)pyrido[2,3-d]pyrimidin-7-one
Names & synonyms
2-amino-6-(2,6-dichlorophenyl)-8-isobutyl-8H-pyrido[2,3-d]pyrimidin-7-onepyrido[2,3-d]pyrimidin-7-one deriv. 8BDBM4053CHEMBL337157SCHEMBL5764386AQUXBIDNWAFZLO-UHFFFAOYSA-N2-amino-6-(2,6-dichlorophenyl)-8-(2-methylpropyl)-7H,8H-pyrido[2,3-d]pyrimidin-7-one
Database identifiers
- PubChem CID
- 5328628
- ChEMBL
CHEMBL337157- Nikkaji
- J1.028.062A
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 503
Related reactions
3 records
Compound notes
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