Basic information
- CAS
64233-34-7- Standard SMILES
Cc1ccc(-c2cnc3c(n2)c(=O)[nH]c(=O)n3C)cc1- InChIKey
MWJNCDZZOLHMNU-UHFFFAOYSA-N- Molecular formula
- C14H12N4O2
- Average molar mass
- 268.27 g/mol
- Monoisotopic mass
- 268.09602564
Names & identifiers
- Preferred name
- 1-Methyl-6-(4-methylphenyl)pteridine-2,4-dione
- IUPAC
- 1-methyl-6-(4-methylphenyl)pteridine-2,4-dione
Names & synonyms
NSC28179164233-34-7DTXSID40314279NSC-2817911-Methyl-6-(4-methylphenyl)pteridine-2,4(1H,3H)-dione
Database identifiers
- CAS
64233-34-7- PubChem CID
- 323064
- DTXSID
DTXSID40314279
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 406
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…