Products for Research Use Only
RegisterLogin

ML366

CAT: 0931-T25822-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T25822-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
851094-56-9
Target
Others, Endogenous Metabolite, DNA/RNA Synthesis
Related Pathways
Cell Cycle/Checkpoint, Others, DNA Damage/DNA Repair, Metabolism
Bioactivity
ML366 is a Vibrio cholerae Quorum Sensing inhibitor Acting via the LuxO response regulator.
Smiles
O=C(NC1=NN=C(O1)C1=CC2=C(OCCO2)C=C1)C1CCCCC1
Molecular Formula
C17H19N3O4
Molecular Weight
329.35
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]cyclohexanecarboxamide
CAS Number851094-56-9
PubChem CID4443990
IUPAC NameN-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]cyclohexanecarboxamide
Molecular FormulaC17H19N3O4
Molecular Weight329.35
XLogP2.7
Topological Polar Surface Area86.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity444
SMILES
C1CCC(CC1)C(=O)NC2=NN=C(O2)C3=CC4=C(C=C3)OCCO4
InChI
InChI=1S/C17H19N3O4/c21-15(11-4-2-1-3-5-11)18-17-20-19-16(24-17)12-6-7-13-14(10-12)23-9-8-22-13/h6-7,10-11H,1-5,8-9H2,(H,18,20,21)
InChIKey
MZDMOTGMRDSIDD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]cyclohexanecarboxamide
CAS: 851094-56-9
CID: 4443990
Formula: C17H19N3O4
MW: 329.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight329.35
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass329.13755610
Monoisotopic Mass329.13755610
Topological Polar Surface Area86.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity444
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

Related Products

CatalogName
T25823ML368
T5425-01ML367
T3555-01ML364
T3594-01ML346
T4316-01ML365
T33453-01ML363

Alternative Products

CatalogName
GTR19198865-01ML366

Popular Products