4-Isopropoxy-N-[2-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-benzamide

HCID 57786807
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Basic information

Standard SMILES
Cc1c(NC(=O)c2ccc(OC(C)C)cc2)cccc1B1OC(C)(C)C(C)(C)O1
InChIKey
FULWHIMLKJDWIR-UHFFFAOYSA-N
Molecular formula
C23H30BNO4
Average molar mass
395.3 g/mol

Names & identifiers

Preferred name
4-Isopropoxy-N-[2-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-benzamide
IUPAC
N-[2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-4-propan-2-yloxybenzamide

Names & synonyms

SCHEMBL2987278FULWHIMLKJDWIR-UHFFFAOYSA-N4-Isopropoxy-N-[2-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-benzamide

Database identifiers

PubChem CID
57786807

Properties

Computed structural properties

Topological polar surface area
56.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
29

Related reactions

2 records
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Compound notes

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