Products for Research Use Only

Sulfo-SPDB

CAT: 0013-GTR19224933-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19224933-01Size:100 mg
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Description
Sulfo-SPDB is a cleavable linker used in antibody-drug conjugate (ADC) synthesis for targeted cancer therapy. It enables controlled drug release in both in vitro and in vivo research settings, facilitating the study of targeted payload delivery and ADC efficacy.
CAS Number
1193111-39-5
Field of Research
Pharmacology & Drug Discovery
Smiles
OS (=O) (=O) C (CCSSc1ccccn1) C (=O) ON1C (=O) CCC1=O
Molecular Formula
C13H14N2O7S3
Molecular Weight
406.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-(2,5-Dioxopyrrolidin-1-yloxy)-1-oxo-4-(pyridin-2-yldisulfanyl)butane-2-sulfonic acid
CAS Number1193111-39-5
PubChem CID53248044
IUPAC Name1-(2,5-dioxopyrrolidin-1-yl)oxy-1-oxo-4-(pyridin-2-yldisulfanyl)butane-2-sulfonic acid
Molecular FormulaC13H14N2O7S3
Molecular Weight406.5
XLogP0
Topological Polar Surface Area190
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Heavy Atom Count25
Formal Charge0
Complexity604
SMILES
C1CC(=O)N(C1=O)OC(=O)C(CCSSC2=CC=CC=N2)S(=O)(=O)O
InChI
InChI=1S/C13H14N2O7S3/c16-11-4-5-12(17)15(11)22-13(18)9(25(19,20)21)6-8-23-24-10-3-1-2-7-14-10/h1-3,7,9H,4-6,8H2,(H,19,20,21)
InChIKey
FUHCFUVCWLZEDQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(2,5-Dioxopyrrolidin-1-yloxy)-1-oxo-4-(pyridin-2-yldisulfanyl)butane-2-sulfonic acid
CAS: 1193111-39-5
CID: 53248044
Formula: C13H14N2O7S3
MW: 406.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight406.5
XLogP30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Exact Mass405.99631431
Monoisotopic Mass405.99631431
Topological Polar Surface Area190 Ų
Heavy Atom Count25
Formal Charge0
Complexity604
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes