Products for Research Use Only
RegisterLogin

BIBU 1361 dihydrochloride

CAT: 0607-B7048-10Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-B7048-10Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
EGFR inhibitor
CAS Number
793726-84-8
Product Name Alternative
N-(3-chloro-4-fluorophenyl)-6-(4-((diethylamino)methyl)piperidin-1-yl)pyrimido[5,4-d]pyrimidin-4-amine dihydrochloride
Field of Research
Tyrosine Kinase EGFR
Purity
0.98
Form
Yellow solid
Solubility
<51.69mg/ml in H2O; <12.92mg/ml in DMSO
Smiles
ClC1=CC(NC2=NC=NC3=CN=C(N=C32)N4CCC(CN(CC)CC)CC4)=CC=C1F.Cl.Cl
Molecular Formula
C22H27ClFN7·2HCl
Molecular Weight
516.87
Shipping Conditions
Blue ice
Storage Conditions
Store at 4°C.

Chemical Information

Bibu 1361 dihydrochloride
CAS Number793726-84-8
PubChem CID46861539
IUPAC NameN-(3-chloro-4-fluorophenyl)-6-[4-(diethylaminomethyl)piperidin-1-yl]pyrimido[5,4-d]pyrimidin-4-amine;dihydrochloride
Molecular FormulaC22H29Cl3FN7
Molecular Weight516.9
Topological Polar Surface Area70.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity546
SMILES
CCN(CC)CC1CCN(CC1)C2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl.Cl.Cl
InChI
InChI=1S/C22H27ClFN7.2ClH/c1-3-30(4-2)13-15-7-9-31(10-8-15)22-25-12-19-20(29-22)21(27-14-26-19)28-16-5-6-18(24)17(23)11-16;;/h5-6,11-12,14-15H,3-4,7-10,13H2,1-2H3,(H,26,27,28);2*1H
InChIKey
ZNNWCQCQUKAMGL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bibu 1361 dihydrochloride
CAS: 793726-84-8
CID: 46861539
Formula: C22H29Cl3FN7
MW: 516.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight516.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass515.153405
Monoisotopic Mass515.153405
Topological Polar Surface Area70.1 Ų
Heavy Atom Count33
Formal Charge0
Complexity546
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

Related Products

CatalogName
A3758-50Retigabine dihydrochloride
B6765-50Rimcazole dihydrochloride
B3342-5.1Spectinomycin dihydrochloride
B7160-10Zoniporide dihydrochloride
A3199-5.1AT7867 dihydrochloride
B5639-25A 412997 dihydrochloride
A3544-10LDK378 dihydrochloride
B5650-5IT1t dihydrochloride
C8521-25DC07090 dihydrochloride
A9926-10Copanlisib dihydrochloride

Alternative Products

CatalogName
254751-01BIBU 1361 dihydrochloride
GTR19209667-01BIBU-1361 dihydrochloride
442682BIBU 1361 Dihydrochloride discontinued. See 254751
ABC-TC0677MG 1361
M21713-01BK-1361
MBS8509462-01IR (Ab-1361) Antibody
35-485Influenza A virus Antibody [1361]
33-789TOP2A Antibody [TOP2A/1361]
GTR19082182-01Recombinant Rat Olfactory receptor 1361 (Olr1361)
NBP2-53281-20ugMouse Monoclonal TOP2A Antibody (TOP2A/1361)

Popular Products