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PD153035

CAT: 0931-T2041-05Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T2041-05Size:100 mg
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CAS Number
153436-54-5
Target
EGFR
Related Pathways
Angiogenesis, JAK/STAT signaling, Tyrosine Kinase/Adaptors
Purity
0.9931
Bioactivity
PD153035 (NSC-669364) hydrochloride is an effective and selective inhibitor of EGFR (Ki/IC50: 5.2/29 pM, in cell-free assays) ; little inhibitory against FGFR, PGDFR, InsR, CSF-1 and Src.
Smiles
COC1=CC2=NC=NC(NC3=CC(Br)=CC=C3)=C2C=C1OC
Molecular Formula
C16H14BrN3O2
Molecular Weight
360.21
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

PD-153035

PD-153035 is a member of the class of quinazolines carrying a 3-bromophenylamino substituent at position 4 and two methoxy substituents at positions 6 and 7. It has a role as an EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor and an epidermal growth factor receptor antagonist. It is an aromatic amine, an aromatic ether, a member of bromobenzenes, a member of quinazolines and a secondary amino compound. It is a conjugate base of a PD-153035(1+).

CAS Number153436-54-5
PubChem CID4705
IUPAC NameN-(3-bromophenyl)-6,7-dimethoxyquinazolin-4-amine
Molecular FormulaC16H14BrN3O2
Molecular Weight360.20
XLogP4
Topological Polar Surface Area56.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity360
SMILES
COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Br)OC
InChI
InChI=1S/C16H14BrN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-4-10(17)6-11/h3-9H,1-2H3,(H,18,19,20)
InChIKey
LSPANGZZENHZNJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PD-153035
CAS: 153436-54-5
CID: 4705
Formula: C16H14BrN3O2
MW: 360.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight360.20
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass359.02694
Monoisotopic Mass359.02694
Topological Polar Surface Area56.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity360
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

Alternative Products

CatalogName
E1KS1079PD153035
A8199-5.1PD153035 hydrochloride
S1079-50mgPD153035 HCl
MBS5811608PD153035 nitrate
HY-12013-01PD153035 (Hydrochloride)

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