N-(2-morpholin-4-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Basic information
- CAS
868268-43-3- Standard SMILES
O=C(Nc1ccccc1N1CCOCC1)c1ccc2c(c1)OCCO2- InChIKey
SQQZPDQLKNXJJP-UHFFFAOYSA-N- Molecular formula
- C19H20N2O4
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.14230712
Names & identifiers
- Preferred name
- N-(2-morpholin-4-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
- IUPAC
- N-(2-morpholin-4-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Names & synonyms
N-(2-morpholin-4-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide868268-43-3N-[2-(morpholin-4-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamideMLS001162473CHEMBL1348390DTXSID901330130HMS2986F17STK947666AKOS000456826SMR000670491Z30484027N-(2-morpholinophenyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamide
Database identifiers
- CAS
868268-43-3- PubChem CID
- 2996589
- DTXSID
DTXSID901330130- ChEMBL
CHEMBL1348390
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 455
Experimental & physicochemical properties
Solubility5.6 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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