Products for Research Use Only
RegisterLogin

Navocaftor

CAT: 0607-BA6620-5Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-BA6620-5Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2159103-66-7
Form
A solid
Molecular Formula
C15H11F3N4O5S
Molecular Weight
416.33
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Navocaftor

Navocaftor is under investigation in clinical trial NCT04853368 (Study to Evaluate Adverse Events and Change in Disease Activity With Oral Capsules of Galicaftor/navocaftor/abbv-119 or Galicaftor/navocaftor/abbv-576 Combination Therapies in Adult Participants With Cystic Fibrosis).

CAS Number2159103-66-7
PubChem CID132189640
IUPAC Name[5-[3-amino-5-[4-(trifluoromethoxy)phenyl]sulfonyl-2-pyridinyl]-1,3,4-oxadiazol-2-yl]methanol
Molecular FormulaC15H11F3N4O5S
Molecular Weight416.3
XLogP0.8
Topological Polar Surface Area150
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity624
SMILES
C1=CC(=CC=C1OC(F)(F)F)S(=O)(=O)C2=CC(=C(N=C2)C3=NN=C(O3)CO)N
InChI
InChI=1S/C15H11F3N4O5S/c16-15(17,18)27-8-1-3-9(4-2-8)28(24,25)10-5-11(19)13(20-6-10)14-22-21-12(7-23)26-14/h1-6,23H,7,19H2
InChIKey
WOXOLLSAICIZNO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Navocaftor
CAS: 2159103-66-7
CID: 132189640
Formula: C15H11F3N4O5S
MW: 416.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight416.3
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count5
Exact Mass416.04022512
Monoisotopic Mass416.04022512
Topological Polar Surface Area150 Ų
Heavy Atom Count28
Formal Charge0
Complexity624
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-109152-01Navocaftor

Popular Products