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WAY-299801

CAT: 0931-T202239-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T202239-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
146430-05-9
Bioactivity
WAY-299801 is an antibacterial compound that demonstrates significant antimycobacterial activity against various Mycobacterium strains and clinically isolated M. tuberculosis in vitro.
Smiles
N=C(NN=CC1=CC(OC)=CC=C1OC)C2=NC=CC=C2
Molecular Formula
C15H16N4O2
Molecular Weight
284.31
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N'-[(2,5-dimethoxyphenyl)methylideneamino]pyridine-2-carboximidamide
CAS Number146430-05-9
PubChem CID457651
IUPAC NameN'-[(2,5-dimethoxyphenyl)methylideneamino]pyridine-2-carboximidamide
Molecular FormulaC15H16N4O2
Molecular Weight284.31
XLogP1.9
Topological Polar Surface Area82.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity373
SMILES
COC1=CC(=C(C=C1)OC)C=NN=C(C2=CC=CC=N2)N
InChI
InChI=1S/C15H16N4O2/c1-20-12-6-7-14(21-2)11(9-12)10-18-19-15(16)13-5-3-4-8-17-13/h3-10H,1-2H3,(H2,16,19)
InChIKey
YYGBRKHKDDYDEM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N'-[(2,5-dimethoxyphenyl)methylideneamino]pyridine-2-carboximidamide
CAS: 146430-05-9
CID: 457651
Formula: C15H16N4O2
MW: 284.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight284.31
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass284.12732577
Monoisotopic Mass284.12732577
Topological Polar Surface Area82.1 Ų
Heavy Atom Count21
Formal Charge0
Complexity373
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count2
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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