CM304

CAT: 0931-T71949-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T71949-01Size:25 mg

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

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CAS Number

1417742-48-3

Target

Others, Sigma receptor

Related Pathways

Others, GPCR/G Protein

Bioactivity

CM304 is a highly selective sigma-1 receptor antagonist.

Smiles

Cl.FCCCc1ccc2n(CCN3CCCCCC3)c(=O)sc2c1

Molecular Formula

C18H26ClFN2OS

Molecular Weight

372.93

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

3-(2-(azepan-1-yl)ethyl)-6-(3-fluoropropyl)benzo(d)thiazol-2(3H)-one hydrochloride

CAS Number	1417742-48-3
PubChem CID	66992999
IUPAC Name	3-[2-(azepan-1-yl)ethyl]-6-(3-fluoropropyl)-1,3-benzothiazol-2-one;hydrochloride
Molecular Formula	C18H26ClFN2OS
Molecular Weight	372.9
Topological Polar Surface Area	48.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	24
Formal Charge	0
Complexity	387

SMILES

C1CCCN(CC1)CCN2C3=C(C=C(C=C3)CCCF)SC2=O.Cl

InChI

InChI=1S/C18H25FN2OS.ClH/c19-9-5-6-15-7-8-16-17(14-15)23-18(22)21(16)13-12-20-10-3-1-2-4-11-20;/h7-8,14H,1-6,9-13H2;1H

InChIKey

IAHXPDSLCDRWPK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1417742-48-3

CID: 66992999

Formula: C18H26ClFN2OS

MW: 372.9

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	372.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	372.1438405
Monoisotopic Mass	372.1438405
Topological Polar Surface Area	48.9 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	387
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	2
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
MBS5814452	CM304
GTR19274749-01	CM304 free base

CM304

Chemical Information

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