4-[[Cyclopropyl[(3,5-dimethyl-4-isoxazolyl)sulfonyl]amino]methyl]benzamide
Basic information
- CAS
1197944-14-1- Standard SMILES
Cc1noc(C)c1S(=O)(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1- InChIKey
FBGVROJCTUAVEK-UHFFFAOYSA-N- Molecular formula
- C16H19N3O4S
- Average molar mass
- 349.4 g/mol
- Monoisotopic mass
- 349.10962727
Names & identifiers
- Preferred name
- 4-[[Cyclopropyl[(3,5-dimethyl-4-isoxazolyl)sulfonyl]amino]methyl]benzamide
- IUPAC
- 4-[[cyclopropyl-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]amino]methyl]benzamide
Names & synonyms
DTXSID4011460054-[[Cyclopropyl[(3,5-dimethyl-4-isoxazolyl)sulfonyl]amino]methyl]benzamideAKOS0341783421197944-14-1Z3198951684-{[Cyclopropyl(3,5-dimethyl-1,2-oxazole-4-sulfonyl)amino]methyl}benzamide
Database identifiers
- CAS
1197944-14-1- PubChem CID
- 45808934
- DTXSID
DTXSID401146005
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 564
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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