Basic information
- CAS
42285-85-8- Standard SMILES
CCn1c(=O)n(C)c(=O)c2nc(-c3ccccc3)nnc21- InChIKey
VOXNDNHSERTDEB-UHFFFAOYSA-N- Molecular formula
- C14H13N5O2
- Average molar mass
- 283.29 g/mol
- Monoisotopic mass
- 283.10692467
Names & identifiers
- Preferred name
- 8-Ethyl-6-methyl-3-phenylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione
- IUPAC
- 8-ethyl-6-methyl-3-phenylpyrimido[5,4-e][1,2,4]triazine-5,7-dione
Names & synonyms
42285-85-8NSC280165DTXSID503140438-Ethyl-6-methyl-3-phenylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dioneNSC-280165DB-070279
Database identifiers
- CAS
42285-85-8- PubChem CID
- 322471
- DTXSID
DTXSID50314043- Nikkaji
- J1.471.216J
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 424
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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