3-(Methylsulfamoyl)phenylboronic Acid Pinacol Ester - CAS 1293987-69-5

Name: 3-(Methylsulfamoyl)phenylboronic Acid Pinacol Ester
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB006986
Product Name:	3-(Methylsulfamoyl)phenylboronic Acid Pinacol Ester
CAS:	1293987-69-5
Synonyms:	N-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide; N-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide

Technical Data

IUPAC Name:	N-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide
Description:	3-(Methylsulfamoyl)phenylboronic Acid Pinacol Ester (CAS# 1293987-69-5) is a useful research chemical.
Molecular Weight:	297.18
Molecular Formula:	C13H20NO4SB
Canonical SMILES:	B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)S(=O)(=O)NC
InChI:	InChI=1S/C13H20BNO4S/c1-12(2)13(3,4)19-14(18-12)10-7-6-8-11(9-10)20(16,17)15-5/h6-9,15H,1-5H3
InChI Key:	YIIPTCFKYOTDME-UHFFFAOYSA-N
LogP:	2.36560

Publication Number	Title	Priority Date
US-2019322655-A1	Novel triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same	20180321
CN-111886233-A	Novel triazolone derivative or salt thereof and pharmaceutical composition comprising the same	20180321
US-10995086-B2	Triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same	20180321
US-2021317110-A1	Triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same	20180321
JP-2017178811-A	Compound having Î³-turn structure and LSD1 inhibitor using the same	20160329

Complexity:	442
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	297.1206095
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	297.1206095
Rotatable Bond Count:	3
Topological Polar Surface Area:	73
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0