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DDD107498

CAT: 1568-C06988-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1568-C06988-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1469439-69-7
Synonyms
M-5717, DDD-498
SKU
C06988-5mg
Target
Parasite
Applications
Microbiology
Smiles
C1CCN (C1) CCNC (=O) C2=CC (=NC3=C2C=C (C=C3) F) C4=CC=C (C=C4) CN5CCOCC5
Molecular Formula
C27H31FN4O2
Additionnal Information
DDD107498 (M-5717, DDD-498) is a P. falciparum translation elongation factor 2 inhibitor. DDD107498 exhibits a potent and novel spectrum of antimalarial activity against multiple life-cycle stages of the Plasmodium parasite.
Storage Conditions
3 years -20°C powder

Chemical Information

Cabamiquine

Cabamiquine is a small molecule drug. Cabamiquine is under investigation in clinical trial NCT05974267 (Efficacy, Safety, and PK of M5717 in Combination With Pyronaridine as Chemoprevention in Adults and Adolescents With Asymptomatic Plasmodium Falciparum Infection (CAPTURE-2)). Cabamiquine has a monoisotopic molecular weight of 462.24 Da.

CAS Number1469439-69-7
PubChem CID71748268
IUPAC Name6-fluoro-2-[4-(morpholin-4-ylmethyl)phenyl]-N-(2-pyrrolidin-1-ylethyl)quinoline-4-carboxamide
Molecular FormulaC27H31FN4O2
Molecular Weight462.6
XLogP3.2
Topological Polar Surface Area57.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count34
Formal Charge0
Complexity647
SMILES
C1CCN(C1)CCNC(=O)C2=CC(=NC3=C2C=C(C=C3)F)C4=CC=C(C=C4)CN5CCOCC5
InChI
InChI=1S/C27H31FN4O2/c28-22-7-8-25-23(17-22)24(27(33)29-9-12-31-10-1-2-11-31)18-26(30-25)21-5-3-20(4-6-21)19-32-13-15-34-16-14-32/h3-8,17-18H,1-2,9-16,19H2,(H,29,33)
InChIKey
BENUHBSJOJMZEE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cabamiquine
CAS: 1469439-69-7
CID: 71748268
Formula: C27H31FN4O2
MW: 462.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight462.6
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass462.24310441
Monoisotopic Mass462.24310441
Topological Polar Surface Area57.7 Ų
Heavy Atom Count34
Formal Charge0
Complexity647
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
A8711-10DDD107498
UXD78171-01DDD107498 succinate

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