Basic information
- CAS
649736-25-4- Standard SMILES
CCOc1ncnn2cc(O)c(C)c12- InChIKey
NEAOGJFZYQUSRN-UHFFFAOYSA-N- Molecular formula
- C9H11N3O2
- Average molar mass
- 193.2 g/mol
- Monoisotopic mass
- 193.0851266
Names & identifiers
- Preferred name
- Pyrrolo[2,1-f][1,2,4]triazin-6-ol, 4-ethoxy-5-methyl-
- IUPAC
- 4-ethoxy-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol
Names & synonyms
649736-25-4Pyrrolo[2,1-f][1,2,4]triazin-6-ol, 4-ethoxy-5-methyl-4-Ethoxy-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-olSCHEMBL1227726DTXSID00469476
Database identifiers
- CAS
649736-25-4- PubChem CID
- 11615332
- DTXSID
DTXSID00469476
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 59.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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