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Ro 20-1724

CAT: 0957-E0346-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0957-E0346-02Size:25 mg
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Description
Ro 20-1724 is a potent inhibitor of PDE IV with Ki value of 3.1 μM and a potent gastric secretagogues.
CAS Number
29925-17-5
Target
PDE
Activity
Metabolism
Molecular Formula
C15H22N2O3
Storage Conditions
3 years -20°C powder

Chemical Information

4-((3-Butoxy-4-methoxyphenyl)methyl)-2-imidazolidinone

4-[(3-butoxy-4-methoxyphenyl)methyl]-2-imidazolidinone is a member of methoxybenzenes.

CAS Number29925-17-5
PubChem CID5087
IUPAC Name4-[(3-butoxy-4-methoxyphenyl)methyl]imidazolidin-2-one
Molecular FormulaC15H22N2O3
Molecular Weight278.35
XLogP2.4
Topological Polar Surface Area59.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count20
Formal Charge0
Complexity311
SMILES
CCCCOC1=C(C=CC(=C1)CC2CNC(=O)N2)OC
InChI
InChI=1S/C15H22N2O3/c1-3-4-7-20-14-9-11(5-6-13(14)19-2)8-12-10-16-15(18)17-12/h5-6,9,12H,3-4,7-8,10H2,1-2H3,(H2,16,17,18)
InChIKey
PDMUULPVBYQBBK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-((3-Butoxy-4-methoxyphenyl)methyl)-2-imidazolidinone
CAS: 29925-17-5
CID: 5087
Formula: C15H22N2O3
MW: 278.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight278.35
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass278.16304257
Monoisotopic Mass278.16304257
Topological Polar Surface Area59.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity311
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