tert-Butyl-2-(6-((2-(acetylamino)-1,3-benzothiazol-4-yl)oxy)pyrimidin-4-yl)-5-(trifluoromethyl)phenylcarbamate

HCID 11957782

Basic information

Standard SMILES
CC(=O)Nc1nc2c(Oc3cc(-c4ccc(C(F)(F)F)cc4NC(=O)OC(C)(C)C)ncn3)cccc2s1
InChIKey
JXKLZZJMXYNAFG-UHFFFAOYSA-N
Molecular formula
C25H22F3N5O4S
Average molar mass
545.5 g/mol

Overview

vanilloid receptor TRPV1 antagonist

Names & identifiers

Preferred name
tert-Butyl-2-(6-((2-(acetylamino)-1,3-benzothiazol-4-yl)oxy)pyrimidin-4-yl)-5-(trifluoromethyl)phenylcarbamate
IUPAC
tert-butyl N-[2-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-5-(trifluoromethyl)phenyl]carbamate

Names & synonyms

659731-59-6RefChem:932756tert-butyl-2-(6-((2-(acetylamino)-1,3-benzothiazol-4-yl)oxy)pyrimidin-4-yl)-5-(trifluoromethyl)phenylcarbamateAMG8163{2-[6-(2-acetylamino-benzothiazol-4-yloxy)-pyrimidin-4-yl]-5-trifluoromethyl-phenyl}carbamic acid tert-butyl estertert-butyl N-[2-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-5-(trifluoromethyl)phenyl]carbamate(2-[6-(2-Acetylamino-benzothiazol-4-yloxy)-pyrimidin-4-yl]-5-trifluoromethyl-phenyl}-carbamic acid tert-butyl ester{2-[6-(2-acetylamino-benzothiazol-4-yloxy)-pyrimidin-4-yl]-5-trifluoromethyl-phenyl}-carbamic acid tert-butyl esterorb1703745SCHEMBL1040737SCHEMBL30875921GLXC-05775
Show more names
AKOS040745555N-[2-[6-[[2-(Acetylamino)-4-benzothiazolyl]oxy]-4-pyrimidinyl]-5-(trifluoromethyl)phenyl]-carbamic acid 1,1-dimethylethyl esterHY-121080T23723N-[2-[6-[[2-(Acetylamino)-4-benzothiazolyl]oxy]-4-pyrimidinyl]-5-(trifluoromethyl)phenyl]-carbamic acid 1,1-dimethylethyl ester; tert-Butyl-2-(6-([2-(acetylamino)-1,3-benzothiazol-4-yl]oxy)pyrimidin-4-yl)-5-(trifluoromethyl)phenylcarbamate

Database identifiers

PubChem CID
11957782

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
144 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
11
Rotatable bonds
7
Heavy atoms
38

Related reactions

8 records

Compound notes

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