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Verazide

CAT: 0926-AAA09347Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-AAA09347Size:100 mg
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CAS Number
93-47-0
MDL Number
MFCD00417512
Smiles
COC1=C (C=C (C=C1) C=NNC (=O) C2=CC=NC=C2) OC
Molecular Formula
C15H15N3O3
Molecular Weight
285.3 g/mol
Controlled
No

Chemical Information

Verazide

Verazide is a small molecule drug. Verazide has a monoisotopic molecular weight of 285.11 Da.

CAS Number93-47-0
PubChem CID9574235
IUPAC NameN-[(E)-(3,4-dimethoxyphenyl)methylideneamino]pyridine-4-carboxamide
Molecular FormulaC15H15N3O3
Molecular Weight285.30
XLogP1.7
Topological Polar Surface Area72.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity356
SMILES
COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC=NC=C2)OC
InChI
InChI=1S/C15H15N3O3/c1-20-13-4-3-11(9-14(13)21-2)10-17-18-15(19)12-5-7-16-8-6-12/h3-10H,1-2H3,(H,18,19)/b17-10+
InChIKey
HPXIKMBHOXLFOR-LICLKQGHSA-N
Chemical Structure
2D Structure
2D structure of Verazide
CAS: 93-47-0
CID: 9574235
Formula: C15H15N3O3
MW: 285.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight285.30
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass285.11134135
Monoisotopic Mass285.11134135
Topological Polar Surface Area72.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity356
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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