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Chemical structure of QL47R

GC71461

QL47R

Also known as 9-(1-methylpyrazol-4-yl)-1-(1-propanoyl-2,3-dihydroindol-6-yl)benzo[h][1,6]naphthyridin-2-one

QL47R is an approximately isosteric analogue of QL47

ChemicalCAS1579278-89-9MW449.5FormulaC27H23N5O2
CAS number
1579278-89-9
Molecular weight
449.5
Formula
C27H23N5O2
Solubility
DMSO ： 100 mg/mL (222·47 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
ZRFYEYDKSDYTQM-UHFFFAOYSA-N
Catalogue number
GC71461
Brand
GLPBIO
Computed properties PubChem CID 137640243 · XLogP 3.1 · TPSA 71.3 Ų · H-bond donors 0
XLogP
3.1
TPSA
71.3 Ų
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
34

SMILES CCC(=O)N1CCC2=C1C=C(C=C2)N3C(=O)C=CC4=CN=C5C=CC(=CC5=C43)C6=CN(N=C6)C

Computed descriptors from PubChem (CID 137640243), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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