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Phenylbenzothiazole-PEG4-OH

CAT: 0013-GTR19218561Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19218561Size:25 mg
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Description
Phenylbenzothiazole-PEG4-OH is a research compound with potential for spinal cord injury therapy, as it may promote spine formation. It is utilized in both in vitro and in vivo studies to investigate neuroregeneration and synaptic repair mechanisms.
CAS Number
2274723-90-7
Purity
99.94% (May vary between batches)
Smiles
OCCOCCOCCOCCOC1=CC=C (C=C1) C2=NC=3C=CC=CC3S2
Molecular Formula
C21H25NO5S
Molecular Weight
403.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Spg302
CAS Number2274723-90-7
PubChem CID137464756
IUPAC Name2-[2-[2-[2-[4-(1,3-benzothiazol-2-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethanol
Molecular FormulaC21H25NO5S
Molecular Weight403.5
XLogP3.1
Topological Polar Surface Area98.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Heavy Atom Count28
Formal Charge0
Complexity408
SMILES
C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)OCCOCCOCCOCCO
InChI
InChI=1S/C21H25NO5S/c23-9-10-24-11-12-25-13-14-26-15-16-27-18-7-5-17(6-8-18)21-22-19-3-1-2-4-20(19)28-21/h1-8,23H,9-16H2
InChIKey
XSAIPEACQNRHOL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Spg302
CAS: 2274723-90-7
CID: 137464756
Formula: C21H25NO5S
MW: 403.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight403.5
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Exact Mass403.14534407
Monoisotopic Mass403.14534407
Topological Polar Surface Area98.3 Ų
Heavy Atom Count28
Formal Charge0
Complexity408
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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TRC-P336635-1G2-Phenylbenzothiazole
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HY-130230-01THP-PEG4-OH
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