化合物产品

Deuruxolitinib

CAS 登记号1513883-39-0
Deuruxolitinib chemical structure
主记录

Deuruxolitinib

CAS
1513883-39-0
PubChem CID
72704611
SMILES
[2H]C1(C(C(C(C1([2H])[2H])([2H])[2H])([2H])[2H])[C@@H](CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3)[2H]
分子式
C17H18N6
分子量
314.4218
精确分子量
314.2095
InChI
InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1/i1D2,2D2,3D2,4D2
InChIKey
HFNKQEVNSGCOJV-FBXGHSCESA-N
LogP
3.4664
TPSA
83.18

名称与别名

  • Deuruxolitinib
  • D8-ruxolitinib
  • Deuruxolitinib-d8
  • Leqselvi
  • Deuruxolitinib [USAN]
  • Ruxolitinib-D8
  • CTP-543
  • Deuruxolitinib (USAN)
  • 0CA0VSF91Y
  • Deuterated Ruxolitinib
  • UNII-0CA0VSF91Y
  • DEURUXOLITINIB [INN]
  • RefChem:132344
  • Deuruxolitinib [WHO-DD]
  • Deuruxolitinib (d8 Major)
  • CTP543
  • 1513883-39-0
  • orb2814017
  • CHEMBL4594381
  • SCHEMBL19555526
  • SCHEMBL29360695
  • GTPL11410
  • WHO 11622
  • DTXSID101358944
  • C-21543
  • HY-50856S
  • AT45874
  • BLP-013520
  • DA-72701
  • CS-0131647