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MS-377

CAT: 1410-M13214Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1410-M13214Size:1 Each
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Description
MS-377 is a potent, selective sigma-1 receptor ligand with Kd of 15.2 nM.
CAS Number
206862-30-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
351.875
Molecular Formula
C18H26ClN3O2
Notes
Research use only, not for human use.
Receptor
Sigma Receptor

Chemical Information

MS-377 free base
CAS Number206862-30-8
PubChem CID9892249
IUPAC Name(3R)-1-(4-chlorophenyl)-3-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrrolidin-2-one
Molecular FormulaC18H26ClN3O2
Molecular Weight351.9
XLogP1.7
Topological Polar Surface Area36
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity407
SMILES
COCCN1CCN(CC1)C[C@H]2CCN(C2=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H26ClN3O2/c1-24-13-12-20-8-10-21(11-9-20)14-15-6-7-22(18(15)23)17-4-2-16(19)3-5-17/h2-5,15H,6-14H2,1H3/t15-/m1/s1
InChIKey
DKVVPXLIRYCKCS-OAHLLOKOSA-N
Chemical Structure
2D Structure
2D structure of MS-377 free base
CAS: 206862-30-8
CID: 9892249
Formula: C18H26ClN3O2
MW: 351.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight351.9
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass351.1713548
Monoisotopic Mass351.1713548
Topological Polar Surface Area36 Ų
Heavy Atom Count24
Formal Charge0
Complexity407
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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