V-161

CAT: 0931-T204979-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T204979-01Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

69570-95-2

Target

ATPase, Antibacterial

Related Pathways

Membrane transporter/Ion channel, Microbiology/Virology

Bioactivity

V-161 is an orally active Na+-V-ATPase inhibitor with an IC50 of 144 nM. Under alkaline conditions, V-161 inhibits Enterococcus hirae and vancomycin-resistant Enterococcus faecium (VRE), with MIC values of 4 μg/mL for both. Additionally, V-161 can inhibit the colonization of VRE in the mouse small intestine.

Smiles

N=1C2=CC(=CC=C2NC1C=3C=CC(=CC3)N(C)C)C

Molecular Formula

C16H17N3

Molecular Weight

251.326

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Stk857277

CAS Number	69570-95-2
PubChem CID	950737
IUPAC Name	N,N-dimethyl-4-(6-methyl-1H-benzimidazol-2-yl)aniline
Molecular Formula	C16H17N3
Molecular Weight	251.33
XLogP	3.7
Topological Polar Surface Area	31.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	19
Formal Charge	0
Complexity	296

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

CAS: 69570-95-2

CID: 950737

Formula: C16H17N3

MW: 251.33

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	251.33
XLogP3	3.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	251.142247555
Monoisotopic Mass	251.142247555
Topological Polar Surface Area	31.9 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	296
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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T209721-01	RTx-161
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T9901A-756-01	GMA-161
T10398-01	ATN-161
T207206-01	KIM-161
T34273-01	RC 161
T7385-01	WT-161
TP3597-01	SHBG (141–161)
T63010	ZXH-1-161

Alternative Products

Catalog	Name
GTR19249675-01	V-161
BA1597-100	WT-161
HY-172964	KIM-161
RFA77420-01	N 161
441888-01	ATN 161
MBS3845737-01	ATN-161
MBS3602418-01	CD 161
TRC-L270000-1G	LCL 161
GTR19222856-01	RC 161
GTR19258320-01	EGFR-IN-161

V-161

Chemical Information

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