AHN-683

CAT: 0931-T23675-03Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T23675-03Size:50 mg

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

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CAS Number

143934-15-0

Target

GABA Receptor, Others

Related Pathways

Others, Membrane transporter/Ion channel, Neuroscience

Bioactivity

AHN-683 is a fluorescent ligand. It was used for peripheral-type benzodiazepine receptors.

Smiles

O=C1OC2(C3=CC=C(O)C=C3OC4=CC(O)=CC=C42)C5=CC=C(C=C15)C(=O)NC=6C=CC(F)=C(C6)C7=NC(=CC=8C=CC=CC87)C(=O)N(C)C(C)CC

Molecular Formula

C42H32FN3O7

Molecular Weight

709.72

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Ahn 683

fluorescent ligand for peripheral-type benzodiazepine receptors; structure given in first source

CAS Number	143934-15-0
PubChem CID	132589
IUPAC Name	N-butan-2-yl-1-[5-[(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-carbonyl)amino]-2-fluorophenyl]-N-methylisoquinoline-3-carboxamide
Molecular Formula	C42H32FN3O7
Molecular Weight	709.7
XLogP	7.3
Topological Polar Surface Area	138
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	6
Heavy Atom Count	53
Formal Charge	0
Complexity	1340

SMILES

CCC(C)N(C)C(=O)C1=CC2=CC=CC=C2C(=N1)C3=C(C=CC(=C3)NC(=O)C4=CC5=C(C=C4)C6(C7=C(C=C(C=C7)O)OC8=C6C=CC(=C8)O)OC5=O)F

InChI

InChI=1S/C42H32FN3O7/c1-4-22(2)46(3)40(50)35-18-23-7-5-6-8-28(23)38(45-35)30-19-25(10-16-34(30)43)44-39(49)24-9-13-31-29(17-24)41(51)53-42(31)32-14-11-26(47)20-36(32)52-37-21-27(48)12-15-33(37)42/h5-22,47-48H,4H2,1-3H3,(H,44,49)

InChIKey

UBHBPMOKEFIASH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 143934-15-0

CID: 132589

Formula: C42H32FN3O7

MW: 709.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	709.7
XLogP3	7.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	6
Exact Mass	709.22242853
Monoisotopic Mass	709.22242853
Topological Polar Surface Area	138 Å²
Heavy Atom Count	53
Formal Charge	0
Complexity	1340
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T29745-01	Ahn 070
T23674-01	AHN 086
TP2156L-01	TAK-683
T39429-01	AHN 1-055 hydrochloride
T9681-01	MAK-683 hydrochloride
T76048-01	TAK-683 acetate
TP2156-01	TAK-683 TFA (872719-49-8 free base)
T30958	CK 683A

Alternative Products

Catalog	Name
GTR19200550-01	AHN-683
HY-118096	AHN 070
HY-113690	AHN 086
GTR19170616-01	AHN 1-055 hydrochloride
HY-P2161	TAK-683
B1972-5	MAK-683
HY-101315-01	AHN 1-055 (hydrochloride)
ARC0315	Hs 683
ABC-TC0411	HS-683
A16922-100	MAK-683 100mg

AHN-683

Chemical Information

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