N,N'-(Piperazine-1,4-diyl)bis[1-(4-chloro-3-nitrophenyl)methanimine]
Basic information
- CAS
21323-08-0- Standard SMILES
O=[N+]([O-])c1cc(C=NN2CCN(N=Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)ccc1Cl- InChIKey
BUMHDHHMVGTQLX-UHFFFAOYSA-N- Molecular formula
- C18H16Cl2N6O4
- Average molar mass
- 451.3 g/mol
- Monoisotopic mass
- 450.0610084
Names & identifiers
- Preferred name
- N,N'-(Piperazine-1,4-diyl)bis[1-(4-chloro-3-nitrophenyl)methanimine]
- IUPAC
- 1-(4-chloro-3-nitrophenyl)-N-[4-[(4-chloro-3-nitrophenyl)methylideneamino]piperazin-1-yl]methanimine
Names & synonyms
21323-08-0DTXSID70943859N,N'-(Piperazine-1,4-diyl)bis[1-(4-chloro-3-nitrophenyl)methanimine]DS-0084741,4-PIPERAZINEDIAMINE,N1,N4-BIS[(4-CHLORO-3-NITROPHENYL)METHYLENE]-
Database identifiers
- CAS
21323-08-0- PubChem CID
- 268384
- DTXSID
DTXSID70943859
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 606
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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