Basic information
- CAS
39050-07-2- Standard SMILES
CC(=O)NCCc1[nH]cnc1N=Nc1c(Cl)cc(Cl)cc1Cl- InChIKey
LNCPKGDVGWXXJJ-UHFFFAOYSA-N- Molecular formula
- C13H12Cl3N5O
- Average molar mass
- 360.6 g/mol
- Monoisotopic mass
- 359.010743
Names & identifiers
- Preferred name
- N-(2-{(4Z)-4-[2-(2,4,6-Trichlorophenyl)hydrazinylidene]-4H-imidazol-5-yl}ethyl)acetamide
- IUPAC
- N-[2-[4-[(2,4,6-trichlorophenyl)diazenyl]-1H-imidazol-5-yl]ethyl]acetamide
Names & synonyms
39050-07-2NSC226183DTXSID00422228NSC-226183N-(2-{(4Z)-4-[2-(2,4,6-Trichlorophenyl)hydrazinylidene]-4H-imidazol-5-yl}ethyl)acetamide
Database identifiers
- CAS
39050-07-2- PubChem CID
- 313085
- DTXSID
DTXSID00422228
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 82.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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