Cas no 88238-38-4 (4-amino-1-[(2r,3s,4s,5r)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-yl]pyrimidin-2-one)

4-amino-1-[(2r,3s,4s,5r)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-yl]pyrimidin-2-one structure
88238-38-4 structure
Product Name:4-amino-1-[(2r,3s,4s,5r)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-yl]pyrimidin-2-one
CAS No:88238-38-4
MF:C10H15N3O5
MW:257.243202447891
CID:1920337
PubChem ID:174674
Update Time:2025-04-21

4-amino-1-[(2r,3s,4s,5r)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-yl]pyrimidin-2-one Chemical and Physical Properties

Names and Identifiers

    • 4-amino-1-[(2r,3s,4s,5r)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-yl]pyrimidin-2-one
    • 2(1H)-Pyrimidinone, 4-amino-1-(5-deoxy-beta-D-arabino-hexofuranosyl)-
    • 88238-38-4
    • DTXSID80236921
    • 4'-Homo-ara-C
    • 1-(5-Deoxy-beta-arabino-hexofuranosyl)cytosine
    • Inchi: 1S/C10H15N3O5/c11-6-1-3-13(10(17)12-6)9-8(16)7(15)5(18-9)2-4-14/h1,3,5,7-9,14-16H,2,4H2,(H2,11,12,17)/t5-,7-,8+,9-/m1/s1
    • InChI Key: LJBKDGZXUROQIV-BUJSFMDZSA-N
    • SMILES: O1[C@H]([C@H]([C@@H]([C@H]1CCO)O)O)N1C(N=C(C=C1)N)=O

Computed Properties

  • Exact Mass: 257.10117059Da
  • Monoisotopic Mass: 257.10117059Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 397
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2
  • Topological Polar Surface Area: 129?2

4-amino-1-[(2r,3s,4s,5r)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-yl]pyrimidin-2-one Related Literature

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