4250-90-2 (((7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)acetaldehyde)

CAS号:
4250-90-2
英文名称:
(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)acetaldehyde
分子式:
C14H12N4O3
分子量:
284.270082473755

(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)acetaldehyde(4250-90-2)名称与标识符

名称

英文别名:
(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)acetaldehyde;2-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)acetaldehyde;7,8-dimethyl-10-formylmethylisoalloxazine;(7,8-Dimethyl-2,4-dioxo-3,4-dihydro-2H-benzo[g]pteridin-10-yl)-acetaldehyd;(7,8-dimethyl-2,4-dioxo-3,4-dihydro-2H-benzo[g]pteridin-10-yl)-acetaldehyde;10-(Formylmethyl)-7,8-dimethylisoalloxazine;2'-oxoethyl flavin;7,8-Dfmi;7,8-dimethyl-10-(formylmethyl)isoalloxazine;7,8-Dimethyl-10-formylmethylflavine-isoalloxazine;AC1L2JHB;AC1Q6QLU;Benzo[g]pteridine-10(2H)-acetaldehyde, 3,4-dihydro-7,8-dimethyl-2,4-dioxo-;Formylmethylflavine;Benzo[g]pteridine-10 (2h)-acetaldehyde, 3,4-dihydro-7,8-dimethyl-2,4-dioxo-;DS-010357;2-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)acetaldehyde;NSC23445;NSC-23445;10-Isoalloxazineacetaldehyde,8-dimethyl-;Benzo(g)pteridine-10(2H)-acetaldehyde, 3,4-dihydro-7,8-dimethyl-2,4-dioxo-;4250-90-2;2-(7,8-dimethyl-2,4-dioxo-3,4-dihydro-2H-benzo[g]pteridin-10-yl)-acetaldehyde;7,8-dimethyl-10-formylmethyl isoalloxazine;Benzo[g]pteridine-10(2H)-acetaldehyde,4-dihydro-7,8-dimethyl-2,4-dioxo-;DTXSID40195287;10-Isoalloxazineacetaldehyde, 7,8-dimethyl-;6,7-Dimethyl-9-formylmethylisoalloxazine;SCHEMBL864130;NSC 23445;

标识符

InChIKey:
AUZWNAFEXXLJDA-UHFFFAOYSA-N
Inchi:
1S/C14H12N4O3/c1-7-5-9-10(6-8(7)2)18(3-4-19)12-11(15-9)13(20)17-14(21)16-12/h4-6H,3H2,1-2H3,(H,17,20,21)
SMILES:
O=C1C2C(=NC(N1)=O)N(CC=O)C1C=C(C)C(C)=CC=1N=2

(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)acetaldehyde(4250-90-2)物化性质

实验特性

  • LogP : 0.44870
  • PSA : 91.2
  • 折射率 : 1.728
  • 密度 : 1.51

计算特性

  • 精确分子量 : 284.09106
  • 氢键供体数量 : 1
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 2
  • 同位素质量 : 284.091
  • 重原子数量 : 21
  • 复杂度 : 569
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 0.6
  • 拓扑分子极性表面积 : 91.2A^2

(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)acetaldehyde(4250-90-2)推荐厂家 更多厂家(3)

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