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Chemical structure of S4

GC50209

S4

Also known as [4-[(3,5-dimethylphenyl)carbamoylamino]phenyl] sulfamate

S4 is a potent and selective inhibitor of carbonic anhydrase IX/XII (CA IX/XII), with a Ki of 7 nM and 2 nM, respectively· S4 also inhibits CA II and CA I (Ki=546 and 5600 nM, respectively)· S4 can inhibit the number of lung metastasis in orthotopic MDA-MB-231 mouse model without affecting primary tumor growth

ChemicalCAS1330061-67-0MW335.38FormulaC15H17N3O4S
CAS number
1330061-67-0
Molecular weight
335.38
Formula
C15H17N3O4S
Solubility
DMSO： 30 mg/ml
InChIKey
HGVHSNXRZYOTPD-UHFFFAOYSA-N
Catalogue number
GC50209
Brand
GLPBIO
Computed properties PubChem CID 53342705 · XLogP 2.1 · TPSA 119 Ų · H-bond donors 3
XLogP
2.1
TPSA
119 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23

SMILES CC1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)OS(=O)(=O)N)C

Computed descriptors from PubChem (CID 53342705), 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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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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