产品名称

英文名称：Macitentan

同义词

EX-A544、MACITENTAN [WHO-DD]、Opsumit (TN)、N-(5-(4-BROMOPHENYL)-6-(2-((5-BROMOPYRIMIDIN-2-YL)OXI)ETHOXY)PYRIMIDIN-4-YL)-N'-PROPYLSULFURIC DIAMIDE、n-(5-(4-bromophenyl)-6-(2-(5-bromopyrimidin-2-yloxy)ethoxy)pyrimidin-4-yl)-n'-propylaminosulfonamide、Sulfamide,、马西替坦

产品性质

CAS编号：441798-33-0

分子式：C19H20Br2N6O4S

分子量：588.27

PubChem编号：16004692

别名：马西替坦

英文别名：EX-A544|MACITENTAN [WHO-DD]|Opsumit (TN)|N-(5-(4-BROMOPHENYL)-6-(2-((5-BROMOPYRIMIDIN-2-YL)OXI)ETHOXY)PYRIMIDIN-4-YL)-N'-PROPYLSULFURIC DIAMIDE|n-(5-(4-bromophenyl)-6-(2-(5-bromopyrimidin-2-yloxy)ethoxy)pyrimidin-4-yl)-n'-propylaminosulfonamide|Sulfamide,

规格或纯度：≥97%

英文名称：Macitentan

储存温度：-20°C储存

运输条件：超低温冰袋运输

备注：25mg、100mg卖完停产，不再备货

产品介绍：Macitentan是一种口服有效的，非肽类，ETA/ETB(内皮素) receptor双重拮抗剂，IC50为0.5 nM/391 nM。Macitentan is an orally active, non-peptide, dual ETA/ETB (endothelin) receptor antagonist with IC50 of 0.5 nM/391 nM.

ALogP：3.7

IUPAC Name：5-(4-bromophenyl)-6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-N-(propylsulfamoyl)pyrimidin-4-amine

INCHI：InChI=1S/C19H20Br2N6O4S/c1-2-7-26-32(28,29)27-17-16(13-3-5-14(20)6-4-13)18(25-12-24-17)30-8-9-31-19-22-10-15(21)11-23-19/h3-6,10-12,26H,2,7-9H2,1H3,(H,24,25,27)

InChi Key：JGCMEBMXRHSZKX-UHFFFAOYSA-N

Canonical SMILES：CCCNS(=O)(=O)NC1=C(C(=NC=N1)OCCOC2=NC=C(C=N2)Br)C3=CC=C(C=C3)Br

Isomeric SMILES：CCCNS(=O)(=O)NC1=C(C(=NC=N1)OCCOC2=NC=C(C=N2)Br)C3=CC=C(C=C3)Br

PubChem CID：16004692

ChEMBL Ligand：CHEMBL2103873

DrugBank Ligand：DB08932

CAS Registry No.：441798-33-0

Wikipedia：Macitentan

PEP：macitentan

DrugCentral Ligand：4809

GPCRdb Ligand：macitentan

溶解性：DMSO 100 mg/mL (169.98 mM);Water <1 mg/mL (<1 mM);Ethanol <1 mg/mL (<1 mM)

象形图：

信号词：Danger

危险声明：H360 May damage fertility or the unborn child

预防措施声明：P280,P405,P501,P203,P318

产品包装