Cas no 1329613-10-6 (Dapivirine-d11)

Dapivirine-d11 structure
Dapivirine-d11 structure
Product Name:Dapivirine-d11
CAS No:1329613-10-6
MF:C20H19N5
MW:340.466141939163
CID:1065389
PubChem ID:71315182
Update Time:2025-04-20

Dapivirine-d11 Chemical and Physical Properties

Names and Identifiers

    • Dapivirine-d11
    • CS-0203652
    • 1329613-10-6
    • 4-[[4-[(2,4,6-Trimethylphenyl-d11)amino]-2-pyrimidinyl]amino]benzonitrile; R 147681-d11; TMC 120-d11; TMC 120R147681-d11;
    • HY-14266S
    • 4-[[4-[3,5-dideuterio-2,4,6-tris(trideuteriomethyl)anilino]pyrimidin-2-yl]amino]benzonitrile
    • Inchi: 1S/C20H19N5/c1-13-10-14(2)19(15(3)11-13)24-18-8-9-22-20(25-18)23-17-6-4-16(12-21)5-7-17/h4-11H,1-3H3,(H2,22,23,24,25)/i1D3,2D3,3D3,10D,11D
    • InChI Key: ILAYIAGXTHKHNT-UXJCIKOESA-N
    • SMILES: N(C1C=CN=C(NC2C=CC(C#N)=CC=2)N=1)C1C(C([2H])([2H])[2H])=C([2H])C(C([2H])([2H])[2H])=C([2H])C=1C([2H])([2H])[2H]

Computed Properties

  • Exact Mass: 340.23308983g/mol
  • Monoisotopic Mass: 340.23308983g/mol
  • Isotope Atom Count: 11
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 4
  • Complexity: 452
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.8
  • Topological Polar Surface Area: 73.6?2

Dapivirine-d11 Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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