40093-93-4 ((1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone)

CAS号:
40093-93-4
英文名称:
1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone
分子式:
C23H20N2O6S
分子量:
452.479704856873

1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone(40093-93-4)名称与标识符

名称

英文别名:
1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone;

标识符

InChIKey:
SCYZYMZYTDXGEY-HBFSDRIKSA-N
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
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

1-(3,5-Di-O-benzoyl-2-deoxy-β-L-erythro-pentofuranosyl)-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone(40093-93-4)物化性质

实验特性

  • 酸度系数(pKa) : 4.84±0.20(Predicted)
  • 密度 : 1.43±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)