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Chemical structure of PAT1inh-B01

GC71304

PAT1inh-B01

Also known as 11-[2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]-5-phenyl-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1(9),2,4-trien-8-one

PAT1inh-B01 is a selective SLC26A6 inhibitor

ChemicalCAS1775330-54-5MW535.32FormulaC22H18BrF3N6O2
CAS number
1775330-54-5
Molecular weight
535.32
Formula
C22H18BrF3N6O2
Solubility
DMSO ： 12·5 mg/mL (23·35 mM; ultrasonic and warming and heat to 60°C; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
GPOYUOYUWZBINV-UHFFFAOYSA-N
Catalogue number
GC71304
Brand
GLPBIO
Computed properties PubChem CID 87052605 · XLogP 2.8 · TPSA 82.8 Ų · H-bond donors 1
XLogP
2.8
TPSA
82.8 Ų
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
34

SMILES CC1=C(C(=NN1CC(=O)N2CCC3=C(C2)C(=O)N4C(=N3)C=C(N4)C5=CC=CC=C5)C(F)(F)F)Br

Computed descriptors from PubChem (CID 87052605), 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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