Cas no 40093-93-4 (1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone)

1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone structure
40093-93-4 structure
Product Name:1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone
CAS No:40093-93-4
MF:C23H20N2O6S
MW:452.479704856873
CID:5682791
Update Time:2024-02-02

1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone Chemical and Physical Properties

Names and Identifiers

    • 1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone
    • Inchi: 1S/C23H20N2O6S/c26-21(15-7-3-1-4-8-15)29-14-18-17(31-22(27)16-9-5-2-6-10-16)13-20(30-18)25-12-11-19(32)24-23(25)28/h1-12,17-18,20H,13-14H2,(H,24,28,32)/t17-,18+,20+/m1/s1
    • InChI Key: SCYZYMZYTDXGEY-HBFSDRIKSA-N
    • SMILES: C1(=O)N([C@H]2O[C@@H](COC(=O)C3=CC=CC=C3)[C@@H](C2)OC(=O)C2=CC=CC=C2)C=CC(=S)N1

Experimental Properties

  • Density: 1.43±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
  • pka: 4.84±0.20(Predicted)
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