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SERCA2a activator A

CAT: 1410-M13416-06Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M13416-06Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SERCA2a activator A is a novel sarco/endoplasmic reticulum Ca2+-dependent ATPase 2a (SERCA2a) activator.
CAS Number
2139330-34-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
551.661
Molecular Formula
C32H29N3O4S
Notes
Research use only, not for human use.
Receptor
Calcium Channel

Chemical Information

SERCA2a activator 1
CAS Number2139330-34-8
PubChem CID146014433
IUPAC Name2-(5-benzyl-1-butyl-6-oxo-3-pyridinyl)-N-naphthalen-2-ylsulfonylpyridine-4-carboxamide
Molecular FormulaC32H29N3O4S
Molecular Weight551.7
XLogP5.4
Topological Polar Surface Area105
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count40
Formal Charge0
Complexity1070
SMILES
CCCCN1C=C(C=C(C1=O)CC2=CC=CC=C2)C3=NC=CC(=C3)C(=O)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C32H29N3O4S/c1-2-3-17-35-22-28(19-27(32(35)37)18-23-9-5-4-6-10-23)30-21-26(15-16-33-30)31(36)34-40(38,39)29-14-13-24-11-7-8-12-25(24)20-29/h4-16,19-22H,2-3,17-18H2,1H3,(H,34,36)
InChIKey
DBGJRQXKIIMWLS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of SERCA2a activator 1
CAS: 2139330-34-8
CID: 146014433
Formula: C32H29N3O4S
MW: 551.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight551.7
XLogP35.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass551.18787759
Monoisotopic Mass551.18787759
Topological Polar Surface Area105 Ų
Heavy Atom Count40
Formal Charge0
Complexity1070
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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