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SC 44914

CAT: 0931-T200107-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T200107-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
115812-74-3
Target
Antibacterial
Related Pathways
Microbiology/Virology
Bioactivity
SC 44914, a quinoxaline compound, exhibits antimicrobial properties. It is active against Campylobacter jejuni, Escherichia coli, and Clostridium difficile.
Smiles
O=N=1C=2C=NC=CC2N3C(=NCC(C)(C3)CC)C1C=4C=CC=CC4
Molecular Formula
C19H20N4O
Molecular Weight
320.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

SC 44914
CAS Number115812-74-3
PubChem CID3082744
IUPAC Name13-ethyl-13-methyl-8-oxido-9-phenyl-1,5,11-triaza-8-azoniatricyclo[8.4.0.02,7]tetradeca-2(7),3,5,8,10-pentaene
Molecular FormulaC19H20N4O
Molecular Weight320.4
XLogP1.5
Topological Polar Surface Area57.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity552
SMILES
CCC1(CN=C2C(=[N+](C3=C(N2C1)C=CN=C3)[O-])C4=CC=CC=C4)C
InChI
InChI=1S/C19H20N4O/c1-3-19(2)12-21-18-17(14-7-5-4-6-8-14)23(24)16-11-20-10-9-15(16)22(18)13-19/h4-11H,3,12-13H2,1-2H3
InChIKey
XQIXJYNCQWWVOB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of SC 44914
CAS: 115812-74-3
CID: 3082744
Formula: C19H20N4O
MW: 320.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight320.4
XLogP31.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass320.16371127
Monoisotopic Mass320.16371127
Topological Polar Surface Area57.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity552
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
GTR19239258-01SC 44914

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