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FDL169

CAT: 1568-C13677-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1568-C13677-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1628416-28-3
SKU
C13677-5mg
Target
CFTR
Applications
Transmembrane Transporters
Smiles
CCOC1=CC2=C (C=C1) C (=NN (C2=O) CC (=O) N (C) C3=CC4=C (C=C3) N=C (O4) C) C5=CC (=CC=C5) F
Molecular Formula
C27H23FN4O4
Additionnal Information
FDL169 is a CFTR corrector that is designed to fix and restore the function of the defective CFTR protein.
Storage Conditions
3 years -20°C powder

Chemical Information

Fdl169
CAS Number1628416-28-3
PubChem CID86298861
IUPAC Name2-[7-ethoxy-4-(3-fluorophenyl)-1-oxophthalazin-2-yl]-N-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)acetamide
Molecular FormulaC27H23FN4O4
Molecular Weight486.5
XLogP4.6
Topological Polar Surface Area88.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count36
Formal Charge0
Complexity856
SMILES
CCOC1=CC2=C(C=C1)C(=NN(C2=O)CC(=O)N(C)C3=CC4=C(C=C3)N=C(O4)C)C5=CC(=CC=C5)F
InChI
InChI=1S/C27H23FN4O4/c1-4-35-20-9-10-21-22(14-20)27(34)32(30-26(21)17-6-5-7-18(28)12-17)15-25(33)31(3)19-8-11-23-24(13-19)36-16(2)29-23/h5-14H,4,15H2,1-3H3
InChIKey
XRPSUWYWZUQALB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fdl169
CAS: 1628416-28-3
CID: 86298861
Formula: C27H23FN4O4
MW: 486.5
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight486.5
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass486.17033339
Monoisotopic Mass486.17033339
Topological Polar Surface Area88.2 Ų
Heavy Atom Count36
Formal Charge0
Complexity856
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
584705FDL169

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