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Basic information
- CAS
897360-68-8- Standard SMILES
COc1ccc(-c2ccc3ncnc(Cl)c3n2)cc1C- InChIKey
SKHBPNNBLBRGDV-UHFFFAOYSA-N- Molecular formula
- C15H12ClN3O
- Average molar mass
- 285.73 g/mol
- Monoisotopic mass
- 285.0668897
Names & identifiers
- Preferred name
- 4-Chloro-6-(4-methoxy-3-methylphenyl)pyrido[3,2-d]pyrimidine
- IUPAC
- 4-chloro-6-(4-methoxy-3-methylphenyl)pyrido[3,2-d]pyrimidine
Names & synonyms
897360-68-84-Chloro-6-(4-methoxy-3-methylphenyl)pyrido[3,2-d]pyrimidine4-chloro-6-(3-methyl-4-methoxyphenyl)-pyrido[3,2-d)pyrimidine4-chloro-6-(3-methyl-4-methoxyphenyl)-pyrido[3,2-d]pyrimidineSCHEMBL4108775DTXSID90828194SKHBPNNBLBRGDV-UHFFFAOYSA-N
Database identifiers
- CAS
897360-68-8- PubChem CID
- 71407697
- DTXSID
DTXSID90828194
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 330
Related reactions
4 records
Compound notes
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