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Chemical structure of DC1-SMe

GC34190

DC1-SMe

Also known as N-[2-[(1S)-1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indole-3-carbonyl]-1H-indol-5-yl]-5-[3-(methyldisulfanyl)propanoylamino]-1H-indole-2-carboxamide

DC1Sme, a DC1 derivative, exhibits IC50 values of 22 pM, 10 pM, 32 pM and 250 pM for Ramos, Namalwa, HL60/s and COLO 205 cancer cells, respectively· DC1, an analogue of the minor groove-binding DNA alkylator CC-1065, is a ADC Cytotoxin· DC1 can be used in synthesis of antibody-drug conjugates for the targeted treatment of cancer

ChemicalCAS501666-85-9MW684.23FormulaC35H30ClN5O4S2
CAS number
501666-85-9
Molecular weight
684.23
Formula
C35H30ClN5O4S2
Solubility
Soluble in DMSO
InChIKey
TVEHPTDUSKNJAT-OAQYLSRUSA-N
Catalogue number
GC34190
Brand
GLPBIO
Computed properties PubChem CID 10327248 · XLogP 5.8 · TPSA 181 Ų · H-bond donors 5
XLogP
5.8
TPSA
181 Ų
H-bond donors
5
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
47

SMILES CSSCCC(=O)NC1=CC2=C(C=C1)NC(=C2)C(=O)NC3=CC4=C(C=C3)NC(=C4)C(=O)N5C[C@H](C6=C5C=C(C7=CC=CC=C76)O)CCl

Computed descriptors from PubChem (CID 10327248), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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