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Chemical structure of (S)-BRD9500

GC73058

(S)-BRD9500

Also known as (4S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-4-methyl-4,5-dihydro-1H-pyridazin-6-one

(S)-BRD9500 is the isomer of BRD9500 , and can be used as an experimental control

ChemicalCAS1630760-76-7MW291.32FormulaC15H18FN3O2
CAS number
1630760-76-7
Molecular weight
291.32
Formula
C15H18FN3O2
Solubility
DMSO : 200 mg/mL (686·53 mM; Need ultrasonic)
InChIKey
GJGGSLDXABLZLP-JTQLQIEISA-N
Catalogue number
GC73058
Brand
GLPBIO
Computed properties PubChem CID 71576738 · XLogP 1.3 · TPSA 53.9 Ų · H-bond donors 1
XLogP
1.3
TPSA
53.9 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
21

SMILES C[C@H]1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCOCC3)F

Computed descriptors from PubChem (CID 71576738), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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