1-Methyl-6-phenylpteridine-2,4-dione
Basic information
- CAS
64233-24-5- Standard SMILES
Cn1c(=O)[nH]c(=O)c2nc(-c3ccccc3)cnc21- InChIKey
ARWDYCFCAYHNNZ-UHFFFAOYSA-N- Molecular formula
- C13H10N4O2
- Average molar mass
- 254.24 g/mol
- Monoisotopic mass
- 254.08037557
Names & identifiers
- Preferred name
- 1-Methyl-6-phenylpteridine-2,4-dione
- IUPAC
- 1-methyl-6-phenylpteridine-2,4-dione
Names & synonyms
64233-24-51-methyl-6-phenylpteridine-2,4-dioneNSC281793CHEMBL171502SCHEMBL6192079ARWDYCFCAYHNNZ-UHFFFAOYSA-DTXSID50314280NSC-2817931-Methyl-6-phenylpteridine-2,4(1H,3H)-dioneInChI=1/C13H10N4O2/c1-17-11-10(12(18)16-13(17)19)15-9(7-14-11)8-5-3-2-4-6-8/h2-7H,1H3,(H,16,18,19)
Database identifiers
- CAS
64233-24-5- PubChem CID
- 323066
- DTXSID
DTXSID50314280- ChEMBL
CHEMBL171502
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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