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NO2-SPP

CAT: 0013-GTR19225129-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19225129-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
NO2-SPP is a cleavable chemical linker designed for constructing antibody-drug conjugates (ADCs) . Its application facilitates targeted drug delivery research, supporting both in vitro cytotoxicity assays and in vivo efficacy studies in oncology and related therapeutic fields.
CAS Number
663598-61-6
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C (ON1C (=O) CCC1=O) CCC (SSC2=NC=C (C=C2) N (=O) =O) C
Molecular Formula
C14H15N3O6S2
Molecular Weight
385.42
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2,5-Dioxopyrrolidin-1-yl 4-((5-nitropyridin-2-yl)disulfanyl)pentanoate
CAS Number663598-61-6
PubChem CID22382871
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 4-[(5-nitro-2-pyridinyl)disulfanyl]pentanoate
Molecular FormulaC14H15N3O6S2
Molecular Weight385.4
XLogP1.3
Topological Polar Surface Area173
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Heavy Atom Count25
Formal Charge0
Complexity525
SMILES
CC(CCC(=O)ON1C(=O)CCC1=O)SSC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C14H15N3O6S2/c1-9(24-25-11-4-3-10(8-15-11)17(21)22)2-7-14(20)23-16-12(18)5-6-13(16)19/h3-4,8-9H,2,5-7H2,1H3
InChIKey
JFSJKWBYKAONEH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dioxopyrrolidin-1-yl 4-((5-nitropyridin-2-yl)disulfanyl)pentanoate
CAS: 663598-61-6
CID: 22382871
Formula: C14H15N3O6S2
MW: 385.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight385.4
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Exact Mass385.04022755
Monoisotopic Mass385.04022755
Topological Polar Surface Area173 Ų
Heavy Atom Count25
Formal Charge0
Complexity525
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

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