Products for Research Use Only

ML367

CAT: 0013-GTR19158171-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19158171-01Size:200 mg
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Description
ML367 is a potent inhibitor of ATPase family AAA domain-containing protein 5 (ATAD5) stabilization and acts as a probe molecule that has low micromolar inhibitory activity.
CAS Number
381168-77-0
Purity
>98% (HPLC)
Solubility
DMSO:120 mg/mL (358.94 mM)
Smiles
Fc1ccc (Nc2nc (nc3ccccc23) -c2ccncc2) cc1F
Molecular Formula
C19H12F2N4
Molecular Weight
334.32
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
(S) -9b- (4-Chlorophenyl) -1- (34-difluorobenzoyl) -23-dihydro-1H-imidazo[21-a]isoindol-5 (9bH) -one

Chemical Information

N-(3,4-difluorophenyl)-2-pyridin-4-ylquinazolin-4-amine
CAS Number381168-77-0
PubChem CID921541
IUPAC NameN-(3,4-difluorophenyl)-2-pyridin-4-ylquinazolin-4-amine
Molecular FormulaC19H12F2N4
Molecular Weight334.3
XLogP4.2
Topological Polar Surface Area50.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity432
SMILES
C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=NC=C3)NC4=CC(=C(C=C4)F)F
InChI
InChI=1S/C19H12F2N4/c20-15-6-5-13(11-16(15)21)23-19-14-3-1-2-4-17(14)24-18(25-19)12-7-9-22-10-8-12/h1-11H,(H,23,24,25)
InChIKey
LBPYNNJXARHGAG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(3,4-difluorophenyl)-2-pyridin-4-ylquinazolin-4-amine
CAS: 381168-77-0
CID: 921541
Formula: C19H12F2N4
MW: 334.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight334.3
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass334.10300272
Monoisotopic Mass334.10300272
Topological Polar Surface Area50.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity432
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes