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HS271

CAT: 0607-BA6063-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0607-BA6063-25Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2410393-15-4
Form
A solid
Molecular Formula
C21H24F3N5O2
Molecular Weight
435.44
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

CID 146386401
CAS Number2410393-15-4
PubChem CID146386401
IUPAC NameN-[2-[2-(dimethylamino)ethyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
Molecular FormulaC21H24F3N5O2
Molecular Weight435.4
XLogP2.8
Topological Polar Surface Area83.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count31
Formal Charge0
Complexity631
SMILES
CC(C)(C1=CC2=NN(C=C2C=C1NC(=O)C3=NC(=CC=C3)C(F)(F)F)CCN(C)C)O
InChI
InChI=1S/C21H24F3N5O2/c1-20(2,31)14-11-16-13(12-29(27-16)9-8-28(3)4)10-17(14)26-19(30)15-6-5-7-18(25-15)21(22,23)24/h5-7,10-12,31H,8-9H2,1-4H3,(H,26,30)
InChIKey
QAOWCAZEVIIQTF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CID 146386401
CAS: 2410393-15-4
CID: 146386401
Formula: C21H24F3N5O2
MW: 435.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight435.4
XLogP32.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass435.18820951
Monoisotopic Mass435.18820951
Topological Polar Surface Area83.3 Ų
Heavy Atom Count31
Formal Charge0
Complexity631
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-131903-01HS271

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