Basic information
- Standard SMILES
Cn1cc2ccc(NC(=O)c3ccccc3NCc3ccnc(NC(=O)N4CCC(O)C4)c3)cc2n1- InChIKey
AXJIHWHZRNJBPJ-UHFFFAOYSA-N- Molecular formula
- C26H27N7O3
- Average molar mass
- 485.5 g/mol
- Monoisotopic mass
- 485.21753775
Names & identifiers
- Preferred name
- 3-hydroxy-pyrrolidine-1-carboxylic acid (4-{[2-(2-methyl-2H-indazol-6-ylcarbamoyl)-phenylamino]-methyl}-pyridin-2-yl)-amide
- IUPAC
- 3-hydroxy-N-[4-[[2-[(2-methylindazol-6-yl)carbamoyl]anilino]methyl]-2-pyridinyl]pyrrolidine-1-carboxamide
Names & synonyms
SCHEMBL13714590AXJIHWHZRNJBPJ-UHFFFAOYSA-N3-hydroxy-pyrrolidine-1-carboxylic acid (4-{[2-(2-methyl-2H-indazol-6-ylcarbamoyl)-phenylamino]-methyl}-pyridin-2-yl)-amide
Database identifiers
- PubChem CID
- 11533181
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 770
Related reactions
2 records
Compound notes
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