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Caracemide

CAT: 0931-T14864-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T14864-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
81424-67-1
Target
DNA/RNA Synthesis, Antibacterial
Related Pathways
Microbiology/Virology, Cell Cycle/Checkpoint, DNA Damage/DNA Repair
Purity
0.998
Bioactivity
Caracemide (NSC-253272) inhibits the enzyme ribonucleotide reductase of Escherichia coli and can be utilized in anticancer studies.
Smiles
CNC(=O)ON(C(C)=O)C(=O)NC
Molecular Formula
C6H11N3O4
Molecular Weight
189.17
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Caracemide

Caracemide is a small molecule drug. Caracemide has a monoisotopic molecular weight of 189.07 Da.

CAS Number81424-67-1
PubChem CID54747
IUPAC Name[acetyl(methylcarbamoyl)amino] N-methylcarbamate
Molecular FormulaC6H11N3O4
Molecular Weight189.17
XLogP-0.2
Topological Polar Surface Area87.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity228
SMILES
CC(=O)N(C(=O)NC)OC(=O)NC
InChI
InChI=1S/C6H11N3O4/c1-4(10)9(5(11)7-2)13-6(12)8-3/h1-3H3,(H,7,11)(H,8,12)
InChIKey
JURAJLFHWXNPHG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Caracemide
CAS: 81424-67-1
CID: 54747
Formula: C6H11N3O4
MW: 189.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight189.17
XLogP3-0.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass189.07495584
Monoisotopic Mass189.07495584
Topological Polar Surface Area87.7 Ų
Heavy Atom Count13
Formal Charge0
Complexity228
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

Alternative Products

CatalogName
BA1574-5Caracemide

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