Products for Research Use Only
RegisterLogin

Imanixil

CAT: 0127-BUP04249-04Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BUP04249-04Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
75689-93-9
Synonyms
HOE-402 free base
Purity
=98%
Smiles
CC1(C)CN(C(=O)N1)c1ncc(C(=O)Nc2cccc(c2)C(F)(F)F)c(N)n1

Chemical Information

Imanixil

Imanixil is a small molecule drug. Imanixil has a monoisotopic molecular weight of 394.14 Da.

CAS Number75689-93-9
PubChem CID216289
IUPAC Name4-amino-2-(4,4-dimethyl-2-oxoimidazolidin-1-yl)-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
Molecular FormulaC17H17F3N6O2
Molecular Weight394.4
XLogP2
Topological Polar Surface Area113
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity614
SMILES
CC1(CN(C(=O)N1)C2=NC=C(C(=N2)N)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C
InChI
InChI=1S/C17H17F3N6O2/c1-16(2)8-26(15(28)25-16)14-22-7-11(12(21)24-14)13(27)23-10-5-3-4-9(6-10)17(18,19)20/h3-7H,8H2,1-2H3,(H,23,27)(H,25,28)(H2,21,22,24)
InChIKey
FUSNOPLQVRUIIM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Imanixil
CAS: 75689-93-9
CID: 216289
Formula: C17H17F3N6O2
MW: 394.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.4
XLogP32
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass394.13650829
Monoisotopic Mass394.13650829
Topological Polar Surface Area113 Ų
Heavy Atom Count28
Formal Charge0
Complexity614
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
BA7860-10Imanixil
HY-101529RImanixil (Standard)

Popular Products