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Chemical structure of Foropafant

GC36066

Foropafant

Also known as N,N-dimethyl-N'-(pyridin-3-ylmethyl)-N'-[4-[2,4,6-tri(propan-2-yl)phenyl]-1,3-thiazol-2-yl]ethane-1,2-diamine

Foropafant (SR27417) highly potent, competitive, selective and orally active antagonist of platelet-activating factor (PAF) receptor, with a Ki value of 57 pM for [3H]PAF binding, at least 5-fold lower than that of unlabeled PAF itself

ChemicalCAS136468-36-5MW464.72FormulaC28H40N4S
CAS number
136468-36-5
Molecular weight
464.72
Formula
C28H40N4S
Solubility
DMSO ： 100 mg/mL (215·18 mM; Need ultrasonic)
InChIKey
VVBFISAUNSXQGZ-UHFFFAOYSA-N
Catalogue number
GC36066
Brand
GLPBIO
Computed properties PubChem CID 119368 · XLogP 6.9 · TPSA 60.5 Ų · H-bond donors 0
XLogP
6.9
TPSA
60.5 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
33

SMILES CC(C)C1=CC(=C(C(=C1)C(C)C)C2=CSC(=N2)N(CCN(C)C)CC3=CN=CC=C3)C(C)C

Computed descriptors from PubChem (CID 119368), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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