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Chemical structure of Syntelin

GC75009

Syntelin

Also known as 2-[[5-[(4-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid

Syntelin is a selective centromere protein E (CENP-E) inhibitor with IC50 at 160 nM

ChemicalCAS438481-33-5MW484.62FormulaC21H20N6O2S3
CAS number
438481-33-5
Molecular weight
484.62
Formula
C21H20N6O2S3
Solubility
DMSO： 50 mg/mL (103·17 mM; Need ultrasonic)
InChIKey
SPRISILOMIVCIR-UHFFFAOYSA-N
Catalogue number
GC75009
Brand
GLPBIO
Computed properties PubChem CID 1587660 · XLogP 4.4 · TPSA 199 Ų · H-bond donors 2
XLogP
4.4
TPSA
199 Ų
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
7
Heavy atoms
32

SMILES C1CCC2=C(C1)C3=C(N=C(N=C3S2)SCC4=NN=C(N4C5=CC=CC=C5)SCC(=O)O)N

Computed descriptors from PubChem (CID 1587660), 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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