AKOS BC-0705

CAT: 0931-T5971-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T5971-01Size:50 mg

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

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CAS Number

1745-07-9

Bioactivity

AKOS BC-0705, with CAS No. 1745-07-9, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. AKOS BC-0705 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.

Smiles

COC1=C(OC)C=C2CNCCC2=C1

Molecular Formula

C11H15NO2

Molecular Weight

193.24

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

6,7-Dimethoxy-1,2,3,4-Tetrahydroisoquinoline

Heliamine is an isoquinoline that is 1,2,3,4-tetrahydroisoquinoline substituted by methoxy groups at positions 6 and 7. It has a role as a plant metabolite. It is an isoquinoline alkaloid, a member of isoquinolines, an aromatic ether and a diether. It is functionally related to a norsalsolinol. It is a conjugate base of a heliamine(1+).

CAS Number	1745-07-9
PubChem CID	15623
IUPAC Name	6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Molecular Formula	C11H15NO2
Molecular Weight	193.24
XLogP	1.3
Topological Polar Surface Area	30.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	186

SMILES

COC1=C(C=C2CNCCC2=C1)OC

InChI

InChI=1S/C11H15NO2/c1-13-10-5-8-3-4-12-7-9(8)6-11(10)14-2/h5-6,12H,3-4,7H2,1-2H3

InChIKey

CEIXWJHURKEBMQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1745-07-9

CID: 15623

Formula: C11H15NO2

MW: 193.24

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	193.24
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	193.110278721
Monoisotopic Mass	193.110278721
Topological Polar Surface Area	30.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	186
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

Related Products

Catalog	Name
T5976-01	AKOS B029051
T14150-01	AKOS-22
T5103-01	AKOS B018304
T9901A-1659-01	BC-010
T89425-01	BC-1293
T8956-01	BC-1258
T8553-01	BC-1471
T26755-01	BC-7013
T78847-01	BC-05
T69977-01	BC-1485

Alternative Products

Catalog	Name
GTR19257427-01	AKOS BC-0705
D3727-66	2-[ (Diphenylmethyl) thio]acetic Acid ((Benzhydrylthio) acetic Acid, Benzhydrylsulfanyl-acetic Acid, AKOS BC-1797)
MBS6099464-01	2-[(Diphenylmethyl)thio]acetic Acid ((Benzhydrylthio)acetic Acid, Benzhydrylsulfanyl-acetic Acid, AKOS BC-1797)
FE171001	BRD 0705
MBS3609912-01	AKOS B018304
7135/50	AKOS 022
GTR19257421-01	AKOS B029051
561047	AKOS-22
A18719-25	AKOS B018304 25mg
A18719-5	AKOS B018304 5mg

AKOS BC-0705

Chemical Information

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