Products for Research Use Only
RegisterLogin

Encorafenib R-Isomer

CAT: 1596-AR-E09817-01Size: 10 UnitsDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1596-AR-E09817-01Size:10 Units
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1269440-29-0
Synonyms
Methyl (R) - (1- ((4- (3- (5-chloro-2-fluoro-3- (methylsulfonamido) phenyl) -1-isopropyl-1H-pyrazol-4-yl) pyrimidin-2-yl) amino) propan-2-yl) carbamate
Molecular Formula
C22H27ClFN7O4S
Molecular Weight
540.01
API Name
Encorafenib

Chemical Information

Encorafenib R-Isomer
CAS Number1269440-29-0
PubChem CID51034015
IUPAC Namemethyl N-[(2R)-1-[[4-[3-[5-chloro-2-fluoro-3-(methanesulfonamido)phenyl]-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamate
Molecular FormulaC22H27ClFN7O4S
Molecular Weight540.0
XLogP2.7
Topological Polar Surface Area149
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count10
Heavy Atom Count36
Formal Charge0
Complexity836
SMILES
C[C@H](CNC1=NC=CC(=N1)C2=CN(N=C2C3=C(C(=CC(=C3)Cl)NS(=O)(=O)C)F)C(C)C)NC(=O)OC
InChI
InChI=1S/C22H27ClFN7O4S/c1-12(2)31-11-16(17-6-7-25-21(28-17)26-10-13(3)27-22(32)35-4)20(29-31)15-8-14(23)9-18(19(15)24)30-36(5,33)34/h6-9,11-13,30H,10H2,1-5H3,(H,27,32)(H,25,26,28)/t13-/m1/s1
InChIKey
CMJCXYNUCSMDBY-CYBMUJFWSA-N
Chemical Structure
2D Structure
2D structure of Encorafenib R-Isomer
CAS: 1269440-29-0
CID: 51034015
Formula: C22H27ClFN7O4S
MW: 540.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight540.0
XLogP32.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count10
Exact Mass539.1517794
Monoisotopic Mass539.1517794
Topological Polar Surface Area149 Ų
Heavy Atom Count36
Formal Charge0
Complexity836
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-E09815-01Encorafenib
AR-M02229-01Montelukast R, R-Isomer
AR-T03469-01Tegoprazan (R Isomer)
AR-D01394-01Deltamethrin R-Isomer
AR-M04524-01Metyrosine R Isomer
AR-L08145-01Lotilaner R-Isomer
AR-N08821-01Nirmatrelvir R-Isomer
AR-E09816-01Encorafenib-d7
AR-B02394-01Bortezomib Impurity (R, R-Isomer)
AR-R11783-01Ruxolitinib Amide (R Isomer)

Alternative Products

CatalogName
RM-E225006-01Encorafenib Impurity 6 (R-Isomer Encorafenib)
T6487-01Encorafenib
TRC-N452480-25MGNirmatrelvir R,R-isomer
RM-S120712-01Saxagliptin (R, R, R, R) -Isomer
RM-D221204-01Desvenlafaxine R-Isomer
TRC-C790003-250MGCR8, (R)-Isomer

Popular Products