5-Methoxy-3-(methoxymethyl)pyrimido[5,4-e][1,2,4]triazine
Basic information
- CAS
30855-44-8- Standard SMILES
COCc1nnc2ncnc(OC)c2n1- InChIKey
NITLLYNMTMPECO-UHFFFAOYSA-N- Molecular formula
- C8H9N5O2
- Average molar mass
- 207.19 g/mol
- Monoisotopic mass
- 207.07562455
Names & identifiers
- Preferred name
- 5-Methoxy-3-(methoxymethyl)pyrimido[5,4-e][1,2,4]triazine
- IUPAC
- 5-methoxy-3-(methoxymethyl)pyrimido[5,4-e][1,2,4]triazine
Names & synonyms
30855-44-85-methoxy-3-(methoxymethyl)pyrimido[5,4-e][1,2,4]triazineNSC143664DTXSID00301483Pyrimido[5,4-e]-1,2,4-triazine,5-methoxy-3-(methoxymethyl)-NSC-143664DS-012399
Database identifiers
- CAS
30855-44-8- PubChem CID
- 285994
- DTXSID
DTXSID00301483
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 82.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
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Compound notes
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