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Foliglurax 1mg

CAT: 0628-A19753-1Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0628-A19753-1Size:1 mg
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CAS Number
1883329-51-8

Chemical Information

Foliglurax dihydrochloride
CAS Number1883329-51-8
PubChem CID135566013
IUPAC Name(NE)-N-[6-(3-morpholin-4-ylpropyl)-2-thieno[3,2-c]pyridin-6-ylchromen-4-ylidene]hydroxylamine;dihydrochloride
Molecular FormulaC23H25Cl2N3O3S
Molecular Weight494.4
Topological Polar Surface Area95.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count32
Formal Charge0
Complexity652
SMILES
C1COCCN1CCCC2=CC\3=C(C=C2)OC(=C/C3=N\O)C4=NC=C5C=CSC5=C4.Cl.Cl
InChI
InChI=1S/C23H23N3O3S.2ClH/c27-25-19-13-22(20-14-23-17(15-24-20)5-11-30-23)29-21-4-3-16(12-18(19)21)2-1-6-26-7-9-28-10-8-26;;/h3-5,11-15,27H,1-2,6-10H2;2*1H/b25-19+;;
InChIKey
WVFFSBHGWAUQIN-DUOAXNJCSA-N
Chemical Structure
2D Structure
2D structure of Foliglurax dihydrochloride
CAS: 1883329-51-8
CID: 135566013
Formula: C23H25Cl2N3O3S
MW: 494.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight494.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass493.0993682
Monoisotopic Mass493.0993682
Topological Polar Surface Area95.4 Ų
Heavy Atom Count32
Formal Charge0
Complexity652
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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