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Bucolome

CAT: 0931-T10632-02Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T10632-02Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
841-73-6
Target
Immunology/Inflammation related, Cytochromes P450
Related Pathways
Immunology/Inflammation, Metabolism
Purity
0.9983
Bioactivity
Bucolome (Paramidine) is a CYP2C9 inhibitor with uricosuric and anti-inflammatory activity.
Smiles
O=C1N(C(=O)NC(=O)C1CCCC)C2CCCCC2
Molecular Formula
C14H22N2O3
Molecular Weight
266.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bucolome

5-butyl-1-cyclohexylbarbituric acid is a member of barbiturates.

CAS Number841-73-6
PubChem CID2461
IUPAC Name5-butyl-1-cyclohexyl-1,3-diazinane-2,4,6-trione
Molecular FormulaC14H22N2O3
Molecular Weight266.34
XLogP2.9
Topological Polar Surface Area66.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity375
SMILES
CCCCC1C(=O)NC(=O)N(C1=O)C2CCCCC2
InChI
InChI=1S/C14H22N2O3/c1-2-3-9-11-12(17)15-14(19)16(13(11)18)10-7-5-4-6-8-10/h10-11H,2-9H2,1H3,(H,15,17,19)
InChIKey
DVEQCIBLXRSYPH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bucolome
CAS: 841-73-6
CID: 2461
Formula: C14H22N2O3
MW: 266.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight266.34
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass266.16304257
Monoisotopic Mass266.16304257
Topological Polar Surface Area66.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity375
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

Alternative Products

CatalogName
BA7290-10Bucolome

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