Basic information
- Standard SMILES
CCS(=O)(=O)Nc1ccc(OCC2CC2)c(B2OC(C)(C)C(C)(C)O2)c1- InChIKey
OFKRMOCKNZIICA-UHFFFAOYSA-N- Molecular formula
- C18H28BNO5S
- Average molar mass
- 381.3 g/mol
Names & identifiers
- Preferred name
- N-(4-(Cyclopropylmethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanesulfonamide
- IUPAC
- N-[4-(cyclopropylmethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanesulfonamide
Names & synonyms
N-(4-(Cyclopropylmethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanesulfonamideSCHEMBL16650483OFKRMOCKNZIICA-UHFFFAOYSA-NA1-549731706752-04-6N-[4-(cyclopropylmethoxy)-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethane-1-sulfonamide
Database identifiers
- PubChem CID
- 123718098
Properties
Computed structural properties
- Topological polar surface area
- 82.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 583
Related reactions
2 records
Compound notes
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