6-Benzyloxy-5-methyl-4-(2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yloxy)-pyrrolo[2,1-f][1,2,4]triazine
Basic information
- Standard SMILES
Cc1cc2cc(Oc3ncnn4cc(OCc5ccccc5)c(C)c34)cnc2[nH]1- InChIKey
SGRDKCSOOXGVLP-UHFFFAOYSA-N- Molecular formula
- C22H19N5O2
- Average molar mass
- 385.4 g/mol
- Monoisotopic mass
- 385.15387487
Names & identifiers
- Preferred name
- 6-Benzyloxy-5-methyl-4-(2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yloxy)-pyrrolo[2,1-f][1,2,4]triazine
- IUPAC
- 5-methyl-4-[(2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)oxy]-6-phenylmethoxypyrrolo[2,1-f][1,2,4]triazine
Names & synonyms
SCHEMBL1683427SGRDKCSOOXGVLP-UHFFFAOYSA-N6-Benzyloxy-5-methyl-4-(2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yloxy)-pyrrolo[2,1-f][1,2,4]triazine
Database identifiers
- PubChem CID
- 22273637
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 77.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 545
Related reactions
2 records
Compound notes
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