Basic information
- Standard SMILES
CC(C)Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1- InChIKey
GWRZAKQWUQRPDF-UHFFFAOYSA-N- Molecular formula
- C17H16Cl2N4O
- Average molar mass
- 363.2 g/mol
- Monoisotopic mass
- 362.0701165
Names & identifiers
- Preferred name
- 2-aminopyrido[2,3-d]pyrimidin-7(8H)-one 23
- IUPAC
- 6-(2,6-dichlorophenyl)-8-methyl-2-(propan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one
Names & synonyms
2-aminopyrido[2,3-d]pyrimidin-7(8H)-one 23BDBM3056CHEMBL109759SCHEMBL5762310GWRZAKQWUQRPDF-UHFFFAOYSA-N6-(2,6-Dichlorophenyl)-2-isopropylamino-8-methyl-8H-pyrido[2,3-d]pyrimidin-7-one6-(2,6-dichlorophenyl)-8-methyl-2-(propan-2-ylamino)-7H,8H-pyrido[2,3-d]pyrimidin-7-one
Database identifiers
- PubChem CID
- 5327870
- ChEMBL
CHEMBL109759- Nikkaji
- J1.012.548K
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 58.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 503
Related reactions
2 records
Compound notes
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