2-Oxoindoline-4-boronic Acid Pinacol Ester - CAS 1150271-44-5

Name: 2-Oxoindoline-4-boronic Acid Pinacol Ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB003466
Product Name:	2-Oxoindoline-4-boronic Acid Pinacol Ester
CAS:	1150271-44-5
Synonyms:	4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-dihydroindol-2-one; 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-dihydroindol-2-one

Technical Data

IUPAC Name:	4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-dihydroindol-2-one
Description:	2-Oxoindoline-4-boronic Acid Pinacol Ester (CAS# 1150271-44-5) is a useful research chemical.
Molecular Weight:	259.11
Molecular Formula:	C14H18NO3B
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=C3CC(=O)NC3=CC=C2
InChI:	InChI=1S/C14H18BNO3/c1-13(2)14(3,4)19-15(18-13)10-6-5-7-11-9(10)8-12(17)16-11/h5-7H,8H2,1-4H3,(H,16,17)
InChI Key:	LDDMKYKRLRAKPL-UHFFFAOYSA-N
Storage:	Keep in dark place, Inert atmosphere, Room temperature
MDL:	MFCD11504971
LogP:	1.61840

Publication Number	Title	Priority Date
JP-2019516761-A	Pyridinedicarboxamide derivatives as bromodomain inhibitors	20160524
KR-20190006567-A	Pyridine Dicarboxamide Derivatives as Bromo Domain Inhibitors	20160524
US-2019202786-A1	Pyridine dicarboxamide derivatives as bromodomain inhibitors	20160524
US-10844015-B2	Pyridine dicarboxamide derivatives as bromodomain inhibitors	20160524
JP-6885968-B2	Pyridine dicarboxamide derivative as a bromodomain inhibitor	20160524

Complexity:	380
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	259.1379736
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	259.1379736
Rotatable Bond Count:	1
Topological Polar Surface Area:	47.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0