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V-161

CAT: 0013-GTR19249675-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19249675-01Size:50 mg
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Description
V-161 is a potent, orally bioavailable Na+-V-ATPase inhibitor (IC50 = 144 nM) effective against Enterococcus hirae and VRE (MIC = 4 μg/mL) . It has demonstrated in vivo efficacy by reducing VRE colonization in the mouse gastrointestinal tract, supporting its use in researching novel antimicrobial strategies.
CAS Number
69570-95-2
Field of Research
Infectious Disease & Virology, Pharmacology & Drug Discovery
Smiles
N=1C2=CC (=CC=C2NC1C=3C=CC (=CC3) N (C) C) C
Molecular Formula
C16H17N3
Molecular Weight
251.326
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Stk857277
CAS Number69570-95-2
PubChem CID950737
IUPAC NameN,N-dimethyl-4-(6-methyl-1H-benzimidazol-2-yl)aniline
Molecular FormulaC16H17N3
Molecular Weight251.33
XLogP3.7
Topological Polar Surface Area31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity296
SMILES
CC1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)N(C)C
InChI
InChI=1S/C16H17N3/c1-11-4-9-14-15(10-11)18-16(17-14)12-5-7-13(8-6-12)19(2)3/h4-10H,1-3H3,(H,17,18)
InChIKey
DCBQWCSRVVGWAN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Stk857277
CAS: 69570-95-2
CID: 950737
Formula: C16H17N3
MW: 251.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight251.33
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass251.142247555
Monoisotopic Mass251.142247555
Topological Polar Surface Area31.9 Ų
Heavy Atom Count19
Formal Charge0
Complexity296
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

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