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AZ 628

CAT: 0607-A8371-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-A8371-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Raf kinases,potent and ATP-competitive
CAS Number
878739-06-1
Product Name Alternative
3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxoquinazolin-6-yl)amino]phenyl]benzamide
Sequence
AZ-628; AZ628
Field of Research
MAPK Signaling Raf
Purity
0.98
Form
A solid
Solubility
≥22.6 mg/mL in DMSO; insoluble in EtOH
Smiles
CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC3=CC4=C(C=C3)N=CN(C4=O)C
Molecular Formula
C27H25N5O2
Molecular Weight
451.53
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

AZ-628

3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxo-6-quinazolinyl)amino]phenyl]benzamide is a member of benzamides.

CAS Number878739-06-1
PubChem CID11676786
IUPAC Name3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxoquinazolin-6-yl)amino]phenyl]benzamide
Molecular FormulaC27H25N5O2
Molecular Weight451.5
XLogP4.2
Topological Polar Surface Area97.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity845
SMILES
CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC3=CC4=C(C=C3)N=CN(C4=O)C
InChI
InChI=1S/C27H25N5O2/c1-17-8-9-21(31-25(33)18-6-5-7-19(12-18)27(2,3)15-28)14-24(17)30-20-10-11-23-22(13-20)26(34)32(4)16-29-23/h5-14,16,30H,1-4H3,(H,31,33)
InChIKey
ZGBGPEDJXCYQPH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AZ-628
CAS: 878739-06-1
CID: 11676786
Formula: C27H25N5O2
MW: 451.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight451.5
XLogP34.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass451.20082506
Monoisotopic Mass451.20082506
Topological Polar Surface Area97.6 Ų
Heavy Atom Count34
Formal Charge0
Complexity845
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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