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Eplivanserin mixture 10mg

CAT: 0628-A21987-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A21987-10Size:10 mg
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CAS Number
130581-13-4

Chemical Information

Eplivanserin

Eplivanserin has been used in trials studying the treatment of Sleep, Insomnia, Chronic Pain, Fibromyalgia, and Primary Insomnia, among others.

CAS Number130581-13-4
PubChem CID135456190
IUPAC Name4-[(E,3Z)-3-[2-(dimethylamino)ethoxyimino]-3-(2-fluorophenyl)prop-1-enyl]phenol
Molecular FormulaC19H21FN2O2
Molecular Weight328.4
XLogP4.1
Topological Polar Surface Area45.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count24
Formal Charge0
Complexity418
SMILES
CN(C)CCO/N=C(/C=C/C1=CC=C(C=C1)O)\C2=CC=CC=C2F
InChI
InChI=1S/C19H21FN2O2/c1-22(2)13-14-24-21-19(17-5-3-4-6-18(17)20)12-9-15-7-10-16(23)11-8-15/h3-12,23H,13-14H2,1-2H3/b12-9+,21-19-
InChIKey
VAIOZOCLKVMIMN-PRJWTAEASA-N
Chemical Structure
2D Structure
2D structure of Eplivanserin
CAS: 130581-13-4
CID: 135456190
Formula: C19H21FN2O2
MW: 328.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight328.4
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass328.15870608
Monoisotopic Mass328.15870608
Topological Polar Surface Area45.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity418
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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