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Chemical structure of BJJF078

GC75307

BJJF078

Also known as 3,4-dimethoxy-N-[5-[4-(prop-2-enoylamino)piperidin-1-yl]sulfonylnaphthalen-1-yl]benzamide

BJJF078 is an aminopiperidine derivative

ChemicalCAS2531244-56-9MW523.6FormulaC27H29N3O6S
CAS number
2531244-56-9
Molecular weight
523.6
Formula
C27H29N3O6S
Solubility
DMSO： 125 mg/mL (238·73 mM; Need ultrasonic)
InChIKey
IJRQXDUGUAWTNT-UHFFFAOYSA-N
Catalogue number
GC75307
Brand
GLPBIO
Computed properties PubChem CID 168006871 · XLogP 3.6 · TPSA 122 Ų · H-bond donors 2
XLogP
3.6
TPSA
122 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
37

SMILES COC1=C(C=C(C=C1)C(=O)NC2=CC=CC3=C2C=CC=C3S(=O)(=O)N4CCC(CC4)NC(=O)C=C)OC

Computed descriptors from PubChem (CID 168006871), 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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