2,5-dichloro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
Basic information
- CAS
638154-43-5- Standard SMILES
O=C(Nc1ccc(CN2CCOCC2)cc1)c1cc(Cl)ccc1Cl- InChIKey
ZDOAMBAWOAKSAW-UHFFFAOYSA-N- Molecular formula
- C18H18Cl2N2O2
- Average molar mass
- 365.2 g/mol
- Monoisotopic mass
- 364.0745332
Names & identifiers
- Preferred name
- 2,5-dichloro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
- IUPAC
- 2,5-dichloro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
- English name
- 2,5-dichloro-N-[4-(4-morpholinylmethyl)phenyl]benzamide
- Molecular formula
- C18H18Cl2N2O2
- Molecular weight
- 365.25
Names & synonyms
2,5-dichloro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide2,5-dichloro-N-[4-(4-morpholinylmethyl)phenyl]benzamideOprea1_849566AP-970/41680386MLS001178538CHEMBL1736871HMS2831L05STK243854AKOS000476196SMR000477743638154-43-5Benzamide, 2,5-dichloro-N-[4-(4-morpholinylmethyl)phenyl]-
Database identifiers
- CAS
638154-43-5- PubChem CID
- 979196
- ChEMBL
CHEMBL1736871
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 410
Experimental & physicochemical properties
Solubility50.1 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Boiling point
- 439.1 · 439.1±45.0 °C(Predicted)
- Density
- 1.354 · 1.354±0.06 g/cm3(Predicted)
- pka
- 12.21 · 12.21±0.70(Predicted)
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Compound notes
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