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Chemical structure of Valecobulin hydrochloride

GC39177

Valecobulin hydrochloride

Also known as (2S)-2-amino-3-methyl-N-[4-[3-(1,2,4-triazol-1-yl)-4-(3,4,5-trimethoxybenzoyl)phenyl]-1,3-thiazol-2-yl]butanamide;hydrochloride

Valecobulin hydrochloride (CKD-516 hydrochloride) is a valine prodrug of S516 and a vascular disrupting agent (VDA)· Valecobulin hydrochloride is a potent β-tubulin polymerization inhibitor with marked antitumor activity against murine and human solid tumors

ChemicalCAS1240321-53-2MW573.06FormulaC26H29ClN6O5S
CAS number
1240321-53-2
Molecular weight
573.06
Formula
C26H29ClN6O5S
Solubility
DMSO： 125 mg/mL (218·13 mM)
InChIKey
FIAUXCMEQTWLQZ-FTBISJDPSA-N
Catalogue number
GC39177
Brand
GLPBIO
Computed properties PubChem CID 46929961 · TPSA 172 Ų · H-bond donors 3 · H-bond acceptors 10
TPSA
172 Ų
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
10
Heavy atoms
39

SMILES CC(C)[C@@H](C(=O)NC1=NC(=CS1)C2=CC(=C(C=C2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC)N4C=NC=N4)N.Cl

Computed descriptors from PubChem (CID 46929961), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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