2-[(2,4-difluorophenyl)sulfonylamino]-N-morpholin-4-ylbenzamide
Basic information
- CAS
748144-27-6- Standard SMILES
O=C(NN1CCOCC1)c1ccccc1NS(=O)(=O)c1ccc(F)cc1F- InChIKey
ADOSYPXMZSYSES-UHFFFAOYSA-N- Molecular formula
- C17H17F2N3O4S
- Average molar mass
- 397.4 g/mol
- Monoisotopic mass
- 397.09078353
Names & identifiers
- Preferred name
- 2-[(2,4-difluorophenyl)sulfonylamino]-N-morpholin-4-ylbenzamide
- IUPAC
- 2-[(2,4-difluorophenyl)sulfonylamino]-N-morpholin-4-ylbenzamide
Names & synonyms
2-[(2,4-difluorophenyl)sulfonylamino]-N-morpholin-4-ylbenzamideMLS002248600CHEMBL1712680DTXSID901330928HMS1723G02HMS3092C06AKOS034460910748144-27-6SMR001316060Z568496262-[(2,4-Difluorobenzene-1-sulfonyl)amino]-N-(morpholin-4-yl)benzamide
Database identifiers
- CAS
748144-27-6- PubChem CID
- 2373085
- DTXSID
DTXSID901330928- ChEMBL
CHEMBL1712680
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 96.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 610
Experimental & physicochemical properties
Solubility57.8 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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