Cas no 1020718-91-5 (N-Acetylsulfathiazole-d4 (Major))

N-Acetylsulfathiazole-d4 (Major) structure
1020718-91-5 structure
Product Name:N-Acetylsulfathiazole-d4 (Major)
CAS No:1020718-91-5
MF:C11H11N3O3S2
MW:301.377986192703
CID:824061
PubChem ID:45359116
Update Time:2024-11-04

N-Acetylsulfathiazole-d4 (Major) Chemical and Physical Properties

Names and Identifiers

    • N-ACETYLSULFATHIAZOLE-D4
    • N-[2,3,5,6-tetradeuterio-4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide
    • N-Acetylsulfathiazole-d4 (Major)
    • N-[4-[(2-ThiazolylaMino)sulfonyl]phenyl-2,3,5,6-d4]acetaMide
    • AKOS030240996
    • CS-0202304
    • J-000568
    • N-{4-[(1,3-Thiazol-2-yl)sulfamoyl](~2~H_4_)phenyl}acetamide
    • 1020718-91-5
    • DTXSID20670103
    • HY-W101327S
    • Acetamide, N-[4-[(2-thiazolylamino)sulfonyl]phenyl-2,3,5,6-d4]-
    • N-(4-(N-(Thiazol-2-yl)sulfamoyl)phenyl)acetamide-d4
    • Inchi: 1S/C11H11N3O3S2/c1-8(15)13-9-2-4-10(5-3-9)19(16,17)14-11-12-6-7-18-11/h2-7H,1H3,(H,12,14)(H,13,15)/i2D,3D,4D,5D
    • InChI Key: KXNXWINFSDKMHD-QFFDRWTDSA-N
    • SMILES: S(C1C([2H])=C([2H])C(=C([2H])C=1[2H])NC(C)=O)(NC1=NC=CS1)(=O)=O

Computed Properties

  • Exact Mass: 301.04900
  • Monoisotopic Mass: 301.04929055g/mol
  • Isotope Atom Count: 4
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 413
  • 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: -0.1
  • Topological Polar Surface Area: 125?2

Experimental Properties

  • Melting Point: 267°C
  • PSA: 124.78000
  • LogP: 3.12910

N-Acetylsulfathiazole-d4 (Major) Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
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$ 173.00 2023-09-09
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