N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(2-oxochromen-7-yl)oxyacetamide
Basic information
- CAS
794540-35-5- Standard SMILES
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)COc1ccc2ccc(=O)oc2c1- InChIKey
YIJPYNHFASROIM-UHFFFAOYSA-N- Molecular formula
- C22H22N2O8S
- Average molar mass
- 474.5 g/mol
- Monoisotopic mass
- 474.10968684
Names & identifiers
- Preferred name
- N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(2-oxochromen-7-yl)oxyacetamide
- IUPAC
- N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(2-oxochromen-7-yl)oxyacetamide
Names & synonyms
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(2-oxochromen-7-yl)oxyacetamideMLS002156439CHEMBL1711737DTXSID401332812HMS3090B15AKOS000832807794540-35-5SMR001238943Z16108514N-[2-Methoxy-5-(morpholine-4-sulfonyl)phenyl]-2-[(2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide
Database identifiers
- CAS
794540-35-5- PubChem CID
- 4833784
- DTXSID
DTXSID401332812- ChEMBL
CHEMBL1711737
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 836
Experimental & physicochemical properties
Solubility6 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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