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Roflumilast-[d3]

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Roflumilast-[d3]

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General Information
Catalog: BLP-013122
CAS: 1189992-00-4
Molecular Formula: C17H11D3Cl2F2N2O3
Molecular Weight: 406.23

Chemical Structure

Description	A deuterated Roflumilast. Roflumilast is a selective, long-acting inhibitor of the enzyme phosphodiesterase-4 (PDE-4).
Synonyms	Daxas-d3; 3-(Cyclopropyl-d4)methoxy-N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)benzamide
IUPAC Name	N-(3,5-dichloropyridin-4-yl)-3-[dideuterio-(1-deuteriocyclopropyl)methoxy]-4-(difluoromethoxy)benzamide
Related CAS	162401-32-3 (unlabelled)
Isomeric SMILES	[2H]C1(CC1)C([2H])([2H])OC2=C(C=CC(=C2)C(=O)NC3=C(C=NC=C3Cl)Cl)OC(F)F
Canonical SMILES	C1CC1COC2=C(C=CC(=C2)C(=O)NC3=C(C=NC=C3Cl)Cl)OC(F)F
InChI	InChI=1S/C17H14Cl2F2N2O3/c18-11-6-22-7-12(19)15(11)23-16(24)10-3-4-13(26-17(20)21)14(5-10)25-8-9-1-2-9/h3-7,9,17H,1-2,8H2,(H,22,23,24)/i8D2,9D
InChI Key	MNDBXUUTURYVHR-YBGYDHGYSA-N
Melting Point	158°C (lit.)
Purity	> 95%
Solubility	DMF: 30 mg/ml, DMSO: 20 mg/ml, Ethanol: 10 mg/ml
Appearance	Solid powder
Storage	Store at -20°C