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ML241

CAT: 0013-GTR19194566-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19194566-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ML241 is a potent and selective p97 ATPase inhibitor. It is a valuable research tool for studying p97-associated pathways in cancer and neurodegenerative diseases, with utility in both in vitro biochemical assays and in vivo model systems.
CAS Number
1346528-06-0
Product Name Alternative
CID49830260
Field of Research
Protein Biochemistry
Purity
>98%
Bioactivity
P97 AAA ATPase inhibitor
Form
Powder
Solubility
Soluble in DMSO (up to 50 mg/ml) or Ethanol (up to 14 mg/ml with warming)
Smiles
C (Nc1nc (nc2CCCCc12) N1CCOc2ccccc12) c1ccccc1
Molecular Formula
C23H24N4O
Molecular Weight
372.46
Storage Conditions
-20°C
Notes
For research use only.
Other Product Names
N-Benzyl-2- (2,3-dihydro-1,4-benzoxazin-4-yl) -5,6,7,8-tetrahydroquinazolin-4-amine

Chemical Information

2-(2H-benzo[b][1,4]oxazin-4(3H)-yl)-N-benzyl-5,6,7,8-tetrahydroquinazolin-4-amine
CAS Number1346528-06-0
PubChem CID49830260
IUPAC NameN-benzyl-2-(2,3-dihydro-1,4-benzoxazin-4-yl)-5,6,7,8-tetrahydroquinazolin-4-amine
Molecular FormulaC23H24N4O
Molecular Weight372.5
XLogP5
Topological Polar Surface Area50.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity497
SMILES
C1CCC2=C(C1)C(=NC(=N2)N3CCOC4=CC=CC=C43)NCC5=CC=CC=C5
InChI
InChI=1S/C23H24N4O/c1-2-8-17(9-3-1)16-24-22-18-10-4-5-11-19(18)25-23(26-22)27-14-15-28-21-13-7-6-12-20(21)27/h1-3,6-9,12-13H,4-5,10-11,14-16H2,(H,24,25,26)
InChIKey
RMZPVQQGYVSLAP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2H-benzo[b][1,4]oxazin-4(3H)-yl)-N-benzyl-5,6,7,8-tetrahydroquinazolin-4-amine
CAS: 1346528-06-0
CID: 49830260
Formula: C23H24N4O
MW: 372.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight372.5
XLogP35
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass372.19501140
Monoisotopic Mass372.19501140
Topological Polar Surface Area50.3 Ų
Heavy Atom Count28
Formal Charge0
Complexity497
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

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