Basic information
- Standard SMILES
CCCOc1cccc(-c2cnc3[nH]cc(C(=O)C(C)(C)C)c3n2)c1- InChIKey
CKODZWUQTGRODU-UHFFFAOYSA-N- Molecular formula
- C20H23N3O2
- Average molar mass
- 337.4 g/mol
Names & identifiers
- Preferred name
- 2,2-Dimethyl-1-[2-(3-propoxy-phenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]-propan-1-one
- IUPAC
- 2,2-dimethyl-1-[2-(3-propoxyphenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]propan-1-one
Names & synonyms
SCHEMBL2277782CKODZWUQTGRODU-UHFFFAOYSA-N2,2-Dimethyl-1-[2-(3-propoxy-phenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]-propan-1-one
Database identifiers
- PubChem CID
- 59540536
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 462
Related reactions
2 records
Compound notes
Loading…