Basic information
- Standard SMILES
NCC(=O)N1CCN(C(=O)c2ccc(C=Cc3n[nH]c4ccccc34)cc2)CC1- InChIKey
RTDLNXWQEDUNNL-UHFFFAOYSA-N- Molecular formula
- C22H23N5O2
- Average molar mass
- 389.4 g/mol
- Monoisotopic mass
- 389.18517499
Names & identifiers
- Preferred name
- 2-amino-1-[4-[4-[2-(1H-indazol-3-yl)ethenyl]benzoyl]piperazin-1-yl]ethanone
- IUPAC
- 2-amino-1-[4-[4-[2-(1H-indazol-3-yl)ethenyl]benzoyl]piperazin-1-yl]ethanone
Database identifiers
- PubChem CID
- 67090487
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 95.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 608
Related reactions
1 records
Compound notes
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