Basic information
- CAS
4036-89-9- Standard SMILES
CCN(CC)c1ccccc1NC(=O)c1cc(O)c(Br)c(O)c1- InChIKey
GWBLGMCMQCZIAU-UHFFFAOYSA-N- Molecular formula
- C17H19BrN2O3
- Average molar mass
- 379.2 g/mol
- Monoisotopic mass
- 378.05791
Names & identifiers
- Preferred name
- 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide
- IUPAC
- 4-bromo-N-[2-(diethylamino)phenyl]-3,5-dihydroxybenzamide
- English name
- 4-bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide
- Molecular formula
- C17H19BrN2O3
- Molecular weight
- 379.24836
Names & synonyms
4036-89-9EINECS 223-721-44-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilideDTXSID60960777GWBLGMCMQCZIAU-UHFFFAOYSA-NNS000492694-Bromo-N-[2-(diethylamino)phenyl]-3,5-dihydroxybenzene-1-carboximidic acid4-Bromo-3,5-dihydroxy-2'-(diethylamino)benzanilide
Database identifiers
- CAS
4036-89-9- PubChem CID
- 77655
- DTXSID
DTXSID60960777- EC Number
- 223-721-4
- Nikkaji
- J217.853B
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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