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BMS 191011

CAT: 0607-B7146-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-B7146-10Size:10 mg
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Description
BKCa channel opener
CAS Number
202821-81-6
Product Name Alternative
3-(5-chloro-2-hydroxybenzyl)-5-(4-(trifluoromethyl)phenyl)-1,3,4-oxadiazol-2(3H)-one
Field of Research
Membrane Transporter Ion Channel Potassium Channel
Purity
0.98
Form
White solid
Solubility
Soluble in DMSO
Smiles
ClC1=CC=C(C(CN2N=C(C3=CC=C(C(F)(F)F)C=C3)OC2=O)=C1)O
Molecular Formula
C16H10ClF3N2O3
Molecular Weight
370.71
Shipping Conditions
Blue ice
Storage Conditions
Store at RT.

Chemical Information

Bms-191011

3-[(5-chloro-2-hydroxyphenyl)methyl]-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-one is a member of (trifluoromethyl)benzenes.

CAS Number202821-81-6
PubChem CID10474339
IUPAC Name3-[(5-chloro-2-hydroxyphenyl)methyl]-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-one
Molecular FormulaC16H10ClF3N2O3
Molecular Weight370.71
XLogP4.3
Topological Polar Surface Area62.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity535
SMILES
C1=CC(=CC=C1C2=NN(C(=O)O2)CC3=C(C=CC(=C3)Cl)O)C(F)(F)F
InChI
InChI=1S/C16H10ClF3N2O3/c17-12-5-6-13(23)10(7-12)8-22-15(24)25-14(21-22)9-1-3-11(4-2-9)16(18,19)20/h1-7,23H,8H2
InChIKey
QKOWACXSXTXRKA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bms-191011
CAS: 202821-81-6
CID: 10474339
Formula: C16H10ClF3N2O3
MW: 370.71
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight370.71
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass370.0332044
Monoisotopic Mass370.0332044
Topological Polar Surface Area62.1 Ų
Heavy Atom Count25
Formal Charge0
Complexity535
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes