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LtaS-IN-1

CAT: 0013-GTR19176699-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19176699-06Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
LtaS-IN-1 is a small molecule inhibitor of lipoteichoic acid synthesis effective against multidrug-resistant Enterococcus faecium. It demonstrates potent antibacterial activity in vitro, with MIC values from 0.5 to 64 μg/mL against various strains, by disrupting cell wall morphology. This compound is a valuable research tool for studying Gram-positive cell wall biosynthesis and novel antibiotic mechanisms.
CAS Number
877950-01-1
Product Name Alternative
Strain E1590, strain E1630, Bacterial, anti-bacterial, E. faecium, Inhibitor, MDR, inhibit, multidrug-resistant, LtaS IN 1, LtaSIN1, LtaS-IN-1
Field of Research
Infectious Disease & Virology
Purity
91.75% (May vary between batches)
Solubility
DMSO:120 mg/mL (280.76 mM) ;10% DMSO+90% Corn Oil:3.3 mg/mL (7.72 mM)
Smiles
O=C (COC (=O) Cc1coc2ccc3ccccc3c12) Nc1nnc (o1) -c1ccccc1
Molecular Formula
C24H17N3O5
Molecular Weight
427.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

[(5-Phenyl-1,3,4-oxadiazol-2-yl)carbamoyl]methyl 2-{naphtho[2,1-b]furan-1-yl}acetate
CAS Number877950-01-1
PubChem CID16286907
IUPAC Name[2-oxo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)amino]ethyl] 2-benzo[e][1]benzofuran-1-ylacetate
Molecular FormulaC24H17N3O5
Molecular Weight427.4
XLogP4.1
Topological Polar Surface Area107
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity670
SMILES
C1=CC=C(C=C1)C2=NN=C(O2)NC(=O)COC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4
InChI
InChI=1S/C24H17N3O5/c28-20(25-24-27-26-23(32-24)16-7-2-1-3-8-16)14-31-21(29)12-17-13-30-19-11-10-15-6-4-5-9-18(15)22(17)19/h1-11,13H,12,14H2,(H,25,27,28)
InChIKey
KNJXREYSQNBQEX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of [(5-Phenyl-1,3,4-oxadiazol-2-yl)carbamoyl]methyl 2-{naphtho[2,1-b]furan-1-yl}acetate
CAS: 877950-01-1
CID: 16286907
Formula: C24H17N3O5
MW: 427.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight427.4
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass427.11682065
Monoisotopic Mass427.11682065
Topological Polar Surface Area107 Ų
Heavy Atom Count32
Formal Charge0
Complexity670
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

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