Basic information
- CAS
754235-40-0- Standard SMILES
Cn1c(-c2cccc([N+](=O)[O-])c2)cnc1NCc1cccc(Cl)c1Cl- InChIKey
MRQIVCNBPAXHDW-UHFFFAOYSA-N- Molecular formula
- C17H14Cl2N4O2
- Average molar mass
- 377.2 g/mol
- Monoisotopic mass
- 376.0493811
Names & identifiers
- Preferred name
- N-(2,3-dichlorobenzyl)-1-methyl-5-(3-nitrophenyl)-1H-imidazol-2-amine
- IUPAC
- N-[(2,3-dichlorophenyl)methyl]-1-methyl-5-(3-nitrophenyl)imidazol-2-amine
Names & synonyms
N-(2,3-dichlorobenzyl)-1-methyl-5-(3-nitrophenyl)-1H-imidazol-2-amineDTXSID701138673STK122017AKOS005401466754235-40-0N-[(2,3-Dichlorophenyl)methyl]-1-methyl-5-(3-nitrophenyl)-1H-imidazol-2-amine
Database identifiers
- CAS
754235-40-0- PubChem CID
- 4527768
- DTXSID
DTXSID701138673
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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