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Chemical structure of Hedgehog Antagonist VIII

GC43809

Hedgehog Antagonist VIII

Also known as 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]methyl]urea

Hedgehog (Hh) proteins, important regulators of development, bind the cell-surface protein Patched, allowing activation of Smoothened

ChemicalCAS330796-24-2MW490.8FormulaC23H15ClF4N4O2
CAS number
330796-24-2
Molecular weight
490.8
Formula
C23H15ClF4N4O2
Solubility
DMF： 30 mg/ml,DMF：PBS(pH7·2) (1：2)： 0·3 mg/ml,DMSO： 25 mg/ml,Ethanol： 10 mg/ml
InChIKey
NYOXUHUPXGFHIB-UHFFFAOYSA-N
Catalogue number
GC43809
Brand
GLPBIO
Computed properties PubChem CID 9913498 · XLogP 4.8 · TPSA 73.8 Ų · H-bond donors 2
XLogP
4.8
TPSA
73.8 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
34

SMILES C1=CC=C2C(=C1)C(=O)N(C(=N2)CNC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)C4=CC=C(C=C4)F

Computed descriptors from PubChem (CID 9913498), 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
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