496018-60-1

(2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide)
2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide结构式图片|496018-60-1结构式图片
2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
496018-60-1
C18H17FN4OS
356.417185544968
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide结构式
656288

名称和标识符

InChIKeyKGAPOBLIDURTOR-UHFFFAOYSA-N
Inchi1S/C18H17FN4OS/c1-23-7-6-16-13(10-23)8-12(9-20)18(22-16)25-11-17(24)21-15-4-2-14(19)3-5-15/h2-5,8H,6-7,10-11H2,1H3,(H,21,24)
SMILESS(CC(NC1C=CC(=CC=1)F)=O)C1C(C#N)=CC2=C(CCN(C)C2)N=1

别名信息

- 中文别名 -

- 英文别名 -

  • BAS 06899911
  • MLS000074418
  • AKOS000665951
  • SS-0712
  • SR-01000363079
  • SMR000013991
  • 2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)thio]-N-(4-fluorophenyl)acetamide
  • 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
  • CHEMBL1519846
  • 496018-60-1
  • cid_656288
  • 2-(3-Cyano-6-methyl-5,6,7,8-tetrahydro-[1,6]naphthyridin-2-ylsulfanyl)-N-(4-fluoro-phenyl)-acetamide
  • SR-01000363079-1
  • BDBM39911
  • 2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
  • 2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)ethanamide

物化性质

计算特性

精确分子量356.11071051g/mol
氢键供体数量1
氢键受体数量6
可旋转化学键数量4
同位素质量356.11071051g/mol
重原子数量25
复杂度517
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)2.3
拓扑分子极性表面积94.3Ų

专业数据库参考

PubChemId656288
960化工网为您提供2-[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide专业化合物百科信息,包括中文名,英文名,分子式,分子量,以及该化合物的CasNo.:496018-60-1,和相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等;| WAP 版:496018-60-1