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Chemical structure of PSI-697

GC37030

PSI-697

Also known as 2-[(4-chlorophenyl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid

PSI-697 is an oral P-selectin inhibitor with an IC50 of 125 μM

ChemicalCAS851546-61-7MW367.83FormulaC21H18ClNO3
CAS number
851546-61-7
Molecular weight
367.83
Formula
C21H18ClNO3
Solubility
DMSO： ≥ 45·8 mg/mL (124·51 mM)
InChIKey
DIEPFYNZGUUVHD-UHFFFAOYSA-N
Catalogue number
GC37030
Brand
GLPBIO
Computed properties PubChem CID 12004316 · XLogP 5.9 · TPSA 70.4 Ų · H-bond donors 2
XLogP
5.9
TPSA
70.4 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26

SMILES C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)Cl)O)C(=O)O

Computed descriptors from PubChem (CID 12004316), 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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