Basic information
- Standard SMILES
CC(=O)Nc1cccc(-c2cncc(Nc3ccc4c(c3)OCO4)n2)c1- InChIKey
VCQYSCPNENRBFZ-UHFFFAOYSA-N- Molecular formula
- C19H16N4O3
- Average molar mass
- 348.4 g/mol
Names & identifiers
- Preferred name
- 2-(3,4-Methylenedioxyphenylamino)-6-(3-acetamidophenyl)pyrazine
- IUPAC
- N-[3-[6-(1,3-benzodioxol-5-ylamino)pyrazin-2-yl]phenyl]acetamide
Names & synonyms
CHEMBL371958SCHEMBL1122160VCQYSCPNENRBFZ-UHFFFAOYSA-NBDBM501803342-(3,4-Methylenedioxyphenylamino)-6-(3-acetamidophenyl)-pyrazine2-(3,4-methylenedioxyphenylamino)-6-(3-acetamidophenyl)pyrazine
Database identifiers
- PubChem CID
- 11501142
- ChEMBL
CHEMBL371958
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 85.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 491
Related reactions
1 records
Compound notes
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