Cas no 65370-91-4 (6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione)

6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione structure
65370-91-4 structure
Product Name:6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione
CAS No:65370-91-4
MF:C8H12N4O6
MW:260.204081535339
CID:961825
PubChem ID:320524
Update Time:2025-04-19

6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione Chemical and Physical Properties

Names and Identifiers

    • 6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione
    • 6-oxo-5-azacytidine
    • AC1L82E5
    • NSC268496
    • SureCN6671219
    • 65370-91-4
    • DTXSID90313292
    • NSC-268496
    • SCHEMBL6671219
    • Inchi: 1S/C8H12N4O6/c9-6-10-7(16)12(8(17)11-6)5-4(15)3(14)2(1-13)18-5/h2-5,13-15H,1H2,(H3,9,10,11,16,17)
    • InChI Key: BOWVQIZEPQZYLW-UHFFFAOYSA-N
    • SMILES: O1C(CO)C(C(C1N1C(N=C(N)NC1=O)=O)O)O

Computed Properties

  • Exact Mass: 260.07576
  • Monoisotopic Mass: 260.07568412g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 412
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2.8
  • Topological Polar Surface Area: 158?2

Experimental Properties

  • PSA: 157.71
  • LogP: -2.88120
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