BDB-108

CAT: 0931-T69510-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T69510-02Size:50 mg

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

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CAS Number

28172-18-1

Target

Others

Related Pathways

Others

Bioactivity

BDB-108 is a re-activator of isopropyl-methylphosphonylated acetylcholinesterase.

Molecular Formula

C16H18Br2N4O2

Molecular Weight

458.15

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Bieloxime

CAS Number	28172-18-1
PubChem CID	135539067
IUPAC Name	(NE)-N-[[1-[(E)-4-[4-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]but-2-enyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine dibromide
Molecular Formula	C16H18Br2N4O2
Molecular Weight	458.1
Topological Polar Surface Area	72.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	24
Formal Charge	0
Complexity	346

SMILES

C1=C[N+](=CC=C1/C=N/O)C/C=C/C[N+]2=CC=C(C=C2)/C=N/O.[Br-].[Br-]

InChI

InChI=1S/C16H16N4O2.2BrH/c21-17-13-15-3-9-19(10-4-15)7-1-2-8-20-11-5-16(6-12-20)14-18-22;;/h1-6,9-14H,7-8H2;2*1H/b2-1+;;

InChIKey

NCYREVBSLCXITJ-SEPHDYHBSA-N

Chemical Structure

2D Structure

CAS: 28172-18-1

CID: 135539067

Formula: C16H18Br2N4O2

MW: 458.1

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	458.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	457.97760
Monoisotopic Mass	455.97965
Topological Polar Surface Area	72.9 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	346
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	3
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

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T77428-01	AMG 108
T203287-01	DTS-108
T28416-01	PIK-108
T82422-01	F1874-108
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Alternative Products

Catalog	Name
GTR19210504-01	BDB-108
M24934-01	PIK-108
A1913-25	RG 108
HY-117869	AFK-108
HY-158153	EGFR-IN-108
MBS130663-01	DBPR-108
MBS5824074	F1874-108
MBS5813920	KRC-108
GTR19274537-01	α-Glucosidase-IN-108
GTR19173387-01	RG-108

BDB-108

Chemical Information

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