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RAF-IN-2

CAT: 0013-GTR19264345-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19264345-01Size:50 mg
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Description
RAF-IN-2 is a RAF inhibitor. This compound can be utilized in research related to proliferative diseases such as leukemia, psoriasis, and fibrosis.
CAS Number
258851-00-2
Field of Research
Neuroscience, Signal Transduction
Smiles
N=1C=CC (=CC1) CC2=CN=C (NC3=CC=C (C=C3) C (C) (C) C) C=4C=CC=CC42
Molecular Formula
C25H25N3
Molecular Weight
367.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(4-(tert-Butyl)phenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine
CAS Number258851-00-2
PubChem CID10090393
IUPAC NameN-(4-tert-butylphenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine
Molecular FormulaC25H25N3
Molecular Weight367.5
XLogP6.5
Topological Polar Surface Area37.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity471
SMILES
CC(C)(C)C1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CC4=CC=NC=C4
InChI
InChI=1S/C25H25N3/c1-25(2,3)20-8-10-21(11-9-20)28-24-23-7-5-4-6-22(23)19(17-27-24)16-18-12-14-26-15-13-18/h4-15,17H,16H2,1-3H3,(H,27,28)
InChIKey
XJGOPYWCSIEHLX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-(tert-Butyl)phenyl)-4-(pyridin-4-ylmethyl)isoquinolin-1-amine
CAS: 258851-00-2
CID: 10090393
Formula: C25H25N3
MW: 367.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight367.5
XLogP36.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass367.204847810
Monoisotopic Mass367.204847810
Topological Polar Surface Area37.8 Ų
Heavy Atom Count28
Formal Charge0
Complexity471
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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Alternative Products

CatalogName
HY-177279RAF-IN-2
T4194-01Raf inhibitor 2
BUP01694-01B-Raf IN 2
R0495-09HRaf (Raf-1, c-Raf) discontinued
A22641-5Raf inhibitor 2 5mg
A22641-25Raf inhibitor 2 25mg
A22641-10Raf inhibitor 2 10mg
A22641-100Raf inhibitor 2 100mg
A22641-2Raf inhibitor 2 2mg
A22641-200Raf inhibitor 2 200mg

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