Name: Macitentan (n-butyl analogue)
Rating: 5 (10 reviews)

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HIT ID:HIT212673192
Cas No:556797-16-1
常用名:Macitentan (n-butyl analogue)
别名:马西替坦正丁基类似物
IUPAC:N-[5-(4-bromophenyl)-6-{2-[(5-bromopyrimidin-2-yl)oxy]ethoxy}pyrimidin-4-yl]butane-1-sulfonamide
IUPAC:N-[5-(4-bromophenyl)-6-{2-[(5-bromopyrimidin-2-yl)oxy]ethoxy}pyrimidin-4-yl]butane-1-sulfonamide
InChI key:OZBDTKLWBSATSN-UHFFFAOYSA-N

分子式:C20H21Br2N5O4S
分子量:587.29
氢键供体数 (HBD):1
氢键受体数 (HBA):8
LogP:4.5142627
SMILES:CCCCS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1
SMILES:CCCCS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1

Macitentan n-butyl analogue, a derivative of Macitentan, functions as an orally active dual antagonist targeting both endothelin ETA and ETB receptors. This compound shows promise for treating idiopathic pulmonary fibrosis (IPF) and pulmonary arterial hypertension (PAH), leveraging its non-peptide structure for potential therapeutic applications.

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