Basic information
- Standard SMILES
CN(C)C(c1ccc(F)cc1Cl)c1c[nH]c2cccc([N+](=O)[O-])c12- InChIKey
MRMGWEVDRYQOAI-UHFFFAOYSA-N- Molecular formula
- C17H15ClFN3O2
- Average molar mass
- 347.8 g/mol
Names & identifiers
- Preferred name
- [(2-Chloro-4-fluoro-phenyl)-(4-nitro-1H-indol-3-yl)-methyl]-dimethyl-amine
- IUPAC
- 1-(2-chloro-4-fluorophenyl)-N,N-dimethyl-1-(4-nitro-1H-indol-3-yl)methanamine
Names & synonyms
SCHEMBL5259610MRMGWEVDRYQOAI-UHFFFAOYSA-N[(2-Chloro-4-fluoro-phenyl)-(4-nitro-1H-indol-3-yl)-methyl]-dimethyl-amine
Database identifiers
- PubChem CID
- 21985305
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 462
Related reactions
2 records
Compound notes
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