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PD153035

CAT: 1568-C11994-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1568-C11994-01Size:5 mg
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CAS Number
153436-54-5
SKU
C11994-5mg
Target
EGFR
Applications
Protein Tyrosine Kinase
Smiles
COC1=C (C=C2C (=C1) C (=NC=N2) NC3=CC (=CC=C3) Br) OC
Molecular Formula
C16H14BrN3O2
Additionnal Information
PD153035 is a specific and potent inhibitor of the epidermal growth factor (EGF) receptor tyrosine kinase (Ki = 5.2 pM) .
Storage Conditions
3 years -20°C powder

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
HY-14346-01PD153035
MBS5811608PD153035 nitrate
S1079-01PD153035 HCl
A8199-50PD153035 hydrochloride
HY-12013-01PD153035 (Hydrochloride)
A10702-50PD153035 50mg
A10702-10PD153035 10mg

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