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CMPDA

CAT: 0607-B5566-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-B5566-10Size:10 mg
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Description
positive allosteric modulator of AMPA receptors
CAS Number
380607-77-2
Product Name Alternative
N,N'-(1,4-phenylenebis(ethane-2,1-diyl))bis(propane-2-sulfonamide)
Field of Research
Membrane Transporter Ion Channel AMPAR
Solubility
Soluble in DMSO
Smiles
CC(S(NCCC1=CC=C(CCNS(C(C)C)(=O)=O)C=C1)(=O)=O)C
Molecular Formula
C16H28N2O4S2
Molecular Weight
376.53
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Cmpda
CAS Number380607-77-2
PubChem CID9969799
IUPAC NameN-[2-[4-[2-(propan-2-ylsulfonylamino)ethyl]phenyl]ethyl]propane-2-sulfonamide
Molecular FormulaC16H28N2O4S2
Molecular Weight376.5
XLogP2.2
Topological Polar Surface Area109
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count24
Formal Charge0
Complexity500
SMILES
CC(C)S(=O)(=O)NCCC1=CC=C(C=C1)CCNS(=O)(=O)C(C)C
InChI
InChI=1S/C16H28N2O4S2/c1-13(2)23(19,20)17-11-9-15-5-7-16(8-6-15)10-12-18-24(21,22)14(3)4/h5-8,13-14,17-18H,9-12H2,1-4H3
InChIKey
FHLGMMYEKXPVSC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cmpda
CAS: 380607-77-2
CID: 9969799
Formula: C16H28N2O4S2
MW: 376.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight376.5
XLogP32.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass376.14904973
Monoisotopic Mass376.14904973
Topological Polar Surface Area109 Ų
Heavy Atom Count24
Formal Charge0
Complexity500
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

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