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Chemical structure of PC SPDP-NHS carbonate ester

GC66852

PC SPDP-NHS carbonate ester

Also known as (2,5-dioxopyrrolidin-1-yl) 1-[5-methoxy-2-nitro-4-[4-oxo-4-[2-(pyridin-2-yldisulfanyl)ethylamino]butoxy]phenyl]ethyl carbonate

PC SPDP-NHS carbonate ester is a cleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs)

ChemicalCAS2279944-61-3MW608.64FormulaC25H28N4O10S2
CAS number
2279944-61-3
Molecular weight
608.64
Formula
C25H28N4O10S2
InChIKey
ZFTXYOZPURXCEF-UHFFFAOYSA-N
Catalogue number
GC66852
Brand
GLPBIO
Computed properties PubChem CID 137334036 · XLogP 2.4 · TPSA 230 Ų · H-bond donors 1
XLogP
2.4
TPSA
230 Ų
H-bond donors
1
H-bond acceptors
13
Rotatable bonds
16
Heavy atoms
41

SMILES CC(C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)NCCSSC2=CC=CC=N2)OC)OC(=O)ON3C(=O)CCC3=O

Computed descriptors from PubChem (CID 137334036), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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