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NO2-SPDMV

CAT: 0931-T18505-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T18505-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
663598-98-9
Target
ADC Linker
Related Pathways
Antibody-drug Conjugate/ADC Related
Bioactivity
NO2-SPDMV is a cleavable linker vital in ADC synthesis. NO2-SPDMV joins cytotoxic drugs to antibodies, enabling precise delivery to cells or proteins. The cleavable nature ensures controlled drug release, optimizing ADC effectiveness.
Smiles
O=C(ON1C(=O)CCC1=O)CCC(SSC2=NC=C(C=C2)N(=O)=O)(C)C
Molecular Formula
C15H17N3O6S2
Molecular Weight
399.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2,5-Dioxopyrrolidin-1-yl 4-methyl-4-((5-nitropyridin-2-yl)disulfanyl)pentanoate
CAS Number663598-98-9
PubChem CID22382878
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 4-methyl-4-[(5-nitro-2-pyridinyl)disulfanyl]pentanoate
Molecular FormulaC15H17N3O6S2
Molecular Weight399.4
XLogP1.5
Topological Polar Surface Area173
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Heavy Atom Count26
Formal Charge0
Complexity564
SMILES
CC(C)(CCC(=O)ON1C(=O)CCC1=O)SSC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C15H17N3O6S2/c1-15(2,26-25-11-4-3-10(9-16-11)18(22)23)8-7-14(21)24-17-12(19)5-6-13(17)20/h3-4,9H,5-8H2,1-2H3
InChIKey
AQKHEWNNTCBJPY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dioxopyrrolidin-1-yl 4-methyl-4-((5-nitropyridin-2-yl)disulfanyl)pentanoate
CAS: 663598-98-9
CID: 22382878
Formula: C15H17N3O6S2
MW: 399.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight399.4
XLogP31.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Exact Mass399.05587762
Monoisotopic Mass399.05587762
Topological Polar Surface Area173 Ų
Heavy Atom Count26
Formal Charge0
Complexity564
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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