Basic information
- Standard SMILES
CS(=O)(=O)Nc1cc(C=Cc2n[nH]c3ccccc23)ccc1OCCN1CCOCC1- InChIKey
AVXWRYFQEDEGGA-UHFFFAOYSA-N- Molecular formula
- C22H26N4O4S
- Average molar mass
- 442.5 g/mol
- Monoisotopic mass
- 442.1674765
Names & identifiers
- Preferred name
- N-[5-[2-(1H-indazol-3-yl)ethenyl]-2-(2-morpholin-4-ylethoxy)phenyl]methanesulfonamide
- IUPAC
- N-[5-[2-(1H-indazol-3-yl)ethenyl]-2-(2-morpholin-4-ylethoxy)phenyl]methanesulfonamide
Names & synonyms
SCHEMBL1597903
Database identifiers
- PubChem CID
- 67090358
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 692
Related reactions
1 records
Compound notes
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