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QNZ 10mg

CAT: 0628-A12748-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A12748-10Size:10 mg
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CAS Number
545380-34-5

Chemical Information

Evp4593

EVP4593 is a member of the class of quinazolines that is quinazoline substituted by [2-(4-phenoxyphenyl)ethyl]amino and amino groups at positions 4 and 6, respectively. It is an inhibitor of NF-B signal transduction pathway and exhibits protective effects in oncology, cardiovascular disease and parasite invasion. It has a role as an antiparasitic agent, an antineoplastic agent, an EC 1.6.5.3 [NADH:ubiquinone reductase (H(+)-translocating)] inhibitor, an anti-inflammatory agent, an apoptosis inducer and a NF-kappaB inhibitor. It is a member of benzenes, an aromatic ether, a member of quinazolines, a primary amino compound and a secondary amino compound.

CAS Number545380-34-5
PubChem CID509554
IUPAC Name4-N-[2-(4-phenoxyphenyl)ethyl]quinazoline-4,6-diamine
Molecular FormulaC22H20N4O
Molecular Weight356.4
XLogP4.7
Topological Polar Surface Area73.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity434
SMILES
C1=CC=C(C=C1)OC2=CC=C(C=C2)CCNC3=NC=NC4=C3C=C(C=C4)N
InChI
InChI=1S/C22H20N4O/c23-17-8-11-21-20(14-17)22(26-15-25-21)24-13-12-16-6-9-19(10-7-16)27-18-4-2-1-3-5-18/h1-11,14-15H,12-13,23H2,(H,24,25,26)
InChIKey
IBAKVEUZKHOWNG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Evp4593
CAS: 545380-34-5
CID: 509554
Formula: C22H20N4O
MW: 356.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight356.4
XLogP34.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass356.16371127
Monoisotopic Mass356.16371127
Topological Polar Surface Area73.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity434
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