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Catramilast

CAT: 0013-GTR19274452-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19274452-01Size:50 mg
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Description
Catramilast is a PDE4D inhibitor used in pain research.
CAS Number
183659-72-5
Smiles
O (CC1CC1) C2=C (OC) C=CC ([C@@H] (CN3C (=O) NC=C3) C) =C2
Molecular Formula
C17H22N2O3
Molecular Weight
302.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Catramilast

Catramilast is a small molecule drug. The usage of the INN stem '-milast' in the name indicates that Catramilast is a Phosphodiesterase-4 (PDE4) inhibitor. Catramilast has a monoisotopic molecular weight of 302.16 Da.

CAS Number183659-72-5
PubChem CID11594630
IUPAC Name3-[(2S)-2-[3-(cyclopropylmethoxy)-4-methoxyphenyl]propyl]-1H-imidazol-2-one
Molecular FormulaC17H22N2O3
Molecular Weight302.37
XLogP2.3
Topological Polar Surface Area50.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count22
Formal Charge0
Complexity422
SMILES
C[C@H](CN1C=CNC1=O)C2=CC(=C(C=C2)OC)OCC3CC3
InChI
InChI=1S/C17H22N2O3/c1-12(10-19-8-7-18-17(19)20)14-5-6-15(21-2)16(9-14)22-11-13-3-4-13/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,18,20)/t12-/m1/s1
InChIKey
ACBYRQONKZKIIY-GFCCVEGCSA-N
Chemical Structure
2D Structure
2D structure of Catramilast
CAS: 183659-72-5
CID: 11594630
Formula: C17H22N2O3
MW: 302.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight302.37
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass302.16304257
Monoisotopic Mass302.16304257
Topological Polar Surface Area50.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity422
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-14918Catramilast

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