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CS 722

CAT: 0931-T31105-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T31105-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
144886-17-9
Target
Others, Endogenous Metabolite
Related Pathways
Metabolism, Others
Bioactivity
CS 722 is a centrally acting muscle relaxant. CS-722 exerts its muscle relaxant action by affecting both the supraspinal structure and the spinal cord.
Smiles
ClC1=C(ON(C[C@@H](CN2CCOCC2)O)C1=O)C3=CC=CC=C3.Cl
Molecular Formula
C16H20Cl2N2O4
Molecular Weight
375.25
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

CS 722

has spinal reflex depressant effects; structure given in first source

CAS Number144886-17-9
PubChem CID132659
IUPAC Name4-chloro-2-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-5-phenyl-1,2-oxazol-3-one;hydrochloride
Molecular FormulaC16H20Cl2N2O4
Molecular Weight375.2
Topological Polar Surface Area62.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity459
SMILES
C1COCCN1C[C@H](CN2C(=O)C(=C(O2)C3=CC=CC=C3)Cl)O.Cl
InChI
InChI=1S/C16H19ClN2O4.ClH/c17-14-15(12-4-2-1-3-5-12)23-19(16(14)21)11-13(20)10-18-6-8-22-9-7-18;/h1-5,13,20H,6-11H2;1H/t13-;/m1./s1
InChIKey
KIWUOCZHZROUNT-BTQNPOSSSA-N
Chemical Structure
2D Structure
2D structure of CS 722
CAS: 144886-17-9
CID: 132659
Formula: C16H20Cl2N2O4
MW: 375.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight375.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass374.0800125
Monoisotopic Mass374.0800125
Topological Polar Surface Area62.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity459
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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