Toprilidine

CAT: 0931-T202182-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T202182-02Size:50 mg

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

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CAS Number

54063-58-0

Bioactivity

Toprilidine is an effective peripheral vasodilator and sedative.

Smiles

N=1C=CC=CC1OCCCN2CCN(C=3C=CC=CC3C)CC2

Molecular Formula

C19H25N3O

Molecular Weight

311.42

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Toprilidine

Toprilidine is a small molecule drug. Toprilidine has a monoisotopic molecular weight of 311.2 Da.

CAS Number	54063-58-0
PubChem CID	68710
IUPAC Name	1-(2-methylphenyl)-4-(3-pyridin-2-yloxypropyl)piperazine
Molecular Formula	C19H25N3O
Molecular Weight	311.4
XLogP	3.5
Topological Polar Surface Area	28.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	23
Formal Charge	0
Complexity	331

SMILES

CC1=CC=CC=C1N2CCN(CC2)CCCOC3=CC=CC=N3

InChI

InChI=1S/C19H25N3O/c1-17-7-2-3-8-18(17)22-14-12-21(13-15-22)11-6-16-23-19-9-4-5-10-20-19/h2-5,7-10H,6,11-16H2,1H3

InChIKey

CRXVPWCHOPXHMN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 54063-58-0

CID: 68710

Formula: C19H25N3O

MW: 311.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	311.4
XLogP3	3.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	311.199762429
Monoisotopic Mass	311.199762429
Topological Polar Surface Area	28.6 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	331
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

Catalog	Name
GTR19242366-01	Toprilidine