N-Benzyl-2-methoxy-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamide

HCID 123789009
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(B2OC(C)(C)C(C)(C)O2)cc1C(=O)NCc1ccccc1
InChIKey
YUEBSBWWAXOZNY-UHFFFAOYSA-N
Molecular formula
C21H26BNO4
Average molar mass
367.2 g/mol
Monoisotopic mass
367.1954885

Names & identifiers

Preferred name
N-Benzyl-2-methoxy-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamide
IUPAC
N-benzyl-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide

Names & synonyms

1706749-35-0N-Benzyl-2-methoxy-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzamideN-benzyl-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamideSCHEMBL16650820YUEBSBWWAXOZNY-UHFFFAOYSA-NDB-211732A1-06266N-benzyl-2-methoxy-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide2-Methoxy-N-(phenylmethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide

Database identifiers

PubChem CID
123789009

Properties

Computed structural properties

Topological polar surface area
56.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
27

Related reactions

2 records
New reaction record

Compound notes

Loading…