Basic information
- Standard SMILES
Nc1ccc(-c2nnc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-]- InChIKey
LOSDVAWPNBWLRJ-UHFFFAOYSA-N- Molecular formula
- C14H9ClN4O3
- Average molar mass
- 316.7 g/mol
Names & identifiers
- Preferred name
- 4-[5-(4-Chloro-phenyl)-[1,3,4]oxadiazol-2-yl]-2-nitro-phenylamine
- IUPAC
- 4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-2-nitroaniline
Names & synonyms
SCHEMBL1250549LOSDVAWPNBWLRJ-UHFFFAOYSA-N4-[5-(4-Chloro-phenyl)-[1,3,4]oxadiazol-2-yl]-2-nitro-phenylamine
Database identifiers
- PubChem CID
- 66965689
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 400
Related reactions
9 records
Compound notes
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