Basic information
- Standard SMILES
Cc1ccc2c(-c3cnc4[nH]cc(C(=O)O)c4n3)nn(C)c2c1- InChIKey
YSMLMWUQLQGQHP-UHFFFAOYSA-N- Molecular formula
- C16H13N5O2
- Average molar mass
- 307.31 g/mol
Names & identifiers
- Preferred name
- 2-(1,6-dimethyl-1H-indazol-3-yl)-5H-pyrrolo[3,2-b]pyrazine-7-carboxylic acid
- IUPAC
- 2-(1,6-dimethylindazol-3-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid
Names & synonyms
SCHEMBL14737679YSMLMWUQLQGQHP-UHFFFAOYSA-N2-(1,6-dimethyl-1H-indazol-3-yl)-5H-pyrrolo[3,2-b]pyrazine-7-carboxylic acid
Database identifiers
- PubChem CID
- 71279878
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 96.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 475
Related reactions
4 records
Compound notes
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