Basic information
- Standard SMILES
CCOc1ccc(NC(=O)Nc2ccccc2[N+](=O)[O-])cc1Br- InChIKey
QFFNHOXEMPGGND-UHFFFAOYSA-N- Molecular formula
- C15H14BrN3O4
- Average molar mass
- 380.19 g/mol
- Monoisotopic mass
- 379.01677
Names & identifiers
- Preferred name
- N-(2-Nitrophenyl)-N'-(3-bromo-4-ethoxyphenyl)-urea
- IUPAC
- 1-(3-bromo-4-ethoxyphenyl)-3-(2-nitrophenyl)urea
Names & synonyms
SCHEMBL8775012QFFNHOXEMPGGND-UHFFFAOYSA-NN-(2-Nitrophenyl)-N'-(3-bromo-4-ethoxyphenyl)-urea
Database identifiers
- PubChem CID
- 21473031
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 96.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 418
Related reactions
6 records
Compound notes
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