5-(Trifluoromethoxy)benzimidazol-2(3H)-one - CAS 877681-12-4

Catalog:	BB038628
Product Name:	5-(Trifluoromethoxy)benzimidazol-2(3H)-one
CAS:	877681-12-4
Synonyms:	5-(trifluoromethoxy)-1,3-dihydrobenzimidazol-2-one; 5-(trifluoromethoxy)-1,3-dihydrobenzimidazol-2-one

Technical Data

Patents

Computed Properties

IUPAC Name:	5-(trifluoromethoxy)-1,3-dihydrobenzimidazol-2-one
Description:	5-(Trifluoromethoxy)benzimidazol-2(3H)-one (CAS# 877681-12-4 ) is a useful research chemical.
Molecular Weight:	218.13
Molecular Formula:	C8H5F3N2O2
Canonical SMILES:	C1=CC2=C(C=C1OC(F)(F)F)NC(=O)N2
InChI:	InChI=1S/C8H5F3N2O2/c9-8(10,11)15-4-1-2-5-6(3-4)13-7(14)12-5/h1-3H,(H2,12,13,14)
InChI Key:	MTWMCTUKHLUSMN-UHFFFAOYSA-N
LogP:	1.75480

Publication Number	Title	Priority Date
JP-2019532950-A	Cyanopyrrolidine derivatives having activity as inhibitors of USP30	20160930
US-2020199126-A1	Cyanopyrrolidine derivatives with activity as inhibitors of usp30	20160930
US-11084821-B2	Cyanopyrrolidine derivatives with activity as inhibitors of USP30	20160930
US-2010216821-A1	Benzimidazoles With A Hetero Spiro-Decane Residue As NPY-Y5 Antagonists	20070424
WO-2008129007-A1	Benzimidazoles with a hetero spiro-decane residue as npy-y5 antagonists	20070424

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Related Functional Groups

Benzimidazoles

[142356-64-7]
2-Amino-5-chloro-6-fluoro-1H-benzo[d]imidazole
[1508258-32-9]
(R)-tert-butyl 3-(2-amino-7-chloro-1H-benzo[d]imidazol-1-yl)azepane-1-carboxylate
[63503-83-3]
2-Hydrazino-4-methyl-1H-benzimidazole
[1245642-98-1]
4-Bromo-6-fluorobenzimidazole
[884069-38-9]
4-(2-Methylbenzimidazolyl)benzenecarbonitrile
[1225283-27-1]
4,5-difluoro-1H-1,3-benzodiazole-2-carboxylic acid

Complexity:	269
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	218.03031189
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	218.03031189
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7