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Enecadin

CAT: 0931-T13677-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0931-T13677-07Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
259525-01-4
Target
Others, Calcium Channel
Related Pathways
Metabolism, Others, Membrane transporter/Ion channel
Purity
0.9853
Bioactivity
Enecadin is a neuroprotective agent.
Smiles
Cc1nc(OCCCCCN2CCCCC2)cc(n1)-c1ccc(F)cc1
Molecular Formula
C21H28FN3O
Molecular Weight
357.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Enecadin

Enecadin has been investigated for the treatment of Stroke.

CAS Number259525-01-4
PubChem CID6433114
IUPAC Name4-(4-fluorophenyl)-2-methyl-6-(5-piperidin-1-ylpentoxy)pyrimidine
Molecular FormulaC21H28FN3O
Molecular Weight357.5
XLogP4.6
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count26
Formal Charge0
Complexity383
SMILES
CC1=NC(=CC(=N1)OCCCCCN2CCCCC2)C3=CC=C(C=C3)F
InChI
InChI=1S/C21H28FN3O/c1-17-23-20(18-8-10-19(22)11-9-18)16-21(24-17)26-15-7-3-6-14-25-12-4-2-5-13-25/h8-11,16H,2-7,12-15H2,1H3
InChIKey
SZSHJTJCJOWMHM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Enecadin
CAS: 259525-01-4
CID: 6433114
Formula: C21H28FN3O
MW: 357.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight357.5
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass357.22164069
Monoisotopic Mass357.22164069
Topological Polar Surface Area38.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity383
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19204353-01Enecadin
A13335-200Enecadin 200mg
A13335-25Enecadin 25mg
HY-100119REnecadin (Standard)
HY-100119AEnecadin (hydrochloride)
A13335-10Enecadin 10mg
A13335-1Enecadin 1mg
MBS5812741Enecadin HCl
A13335-100Enecadin 100mg
A13335-50Enecadin 50mg

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