N-(2,4-Dimethoxybenzyl)-5-fluoro-2-thiazolamine - CAS 2007920-92-3

Catalog:	BB015641
Product Name:	N-(2,4-Dimethoxybenzyl)-5-fluoro-2-thiazolamine
CAS:	2007920-92-3
Synonyms:	N-[(2,4-dimethoxyphenyl)methyl]-5-fluoro-2-thiazolamine; N-[(2,4-dimethoxyphenyl)methyl]-5-fluoro-1,3-thiazol-2-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	N-[(2,4-dimethoxyphenyl)methyl]-5-fluoro-1,3-thiazol-2-amine
Description:	N-(2,4-Dimethoxybenzyl)-5-fluoro-2-thiazolamine (CAS# 2007920-92-3 ) is a useful research chemical.
Molecular Weight:	268.31
Molecular Formula:	C12H13FN2O2S
Canonical SMILES:	COC1=CC(=C(C=C1)CNC2=NC=C(S2)F)OC
InChI:	InChI=1S/C12H13FN2O2S/c1-16-9-4-3-8(10(5-9)17-2)6-14-12-15-7-11(13)18-12/h3-5,7H,6H2,1-2H3,(H,14,15)
InChI Key:	RFPVMLIIPGNCFR-UHFFFAOYSA-N
LogP:	2.98450

Publication Number	Title	Priority Date
WO-2020117626-A1	4-amino or 4-alkoxy-substituted aryl sulfonamide compounds with selective activity in voltage-gated sodium channels	20181205
EP-3891157-A1	4-amino or 4-alkoxy-substituted aryl sulfonamide compounds with selective activity in voltage-gated sodium channels	20181205
EP-3551626-A1	Benzenesulfonamide compounds and their use as therapeutic agents	20161209
JP-2019536810-A	Benzenesulfonamide compounds and their use as therapeutic agents	20161209
KR-20190086772-A	Benzenesulfonamide compounds and their use as therapeutic agents	20161209

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Complexity:	260
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	268.068177
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	268.068177
Rotatable Bond Count:	5
Topological Polar Surface Area:	71.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1