1-羟基-4-[[3-甲基-4-[[(5-甲基 -1,3,4-恶二唑-2-基)硫代]-甲基-1- 苯基-1H-吡唑-5-基]氧基]-N-(4-十四 烷氧苯基)-2-萘甲酰胺
2-Naphthalenecarboxamide, 1-hydroxy-4-[[3-methyl-4-[[(5-methyl-1,3,4-oxadiazol-2-yl)thio]methyl]-1-phenyl-1H-pyrazol-5-yl]oxy]-N-[4-(tetradecyloxy)phenyl]- · CAS 107703-70-8
- 中文名
- 1-羟基-4-[[3-甲基-4-[[(5-甲基 -1,3,4-恶二唑-2-基)硫代]-甲基-1- 苯基-1H-吡唑-5-基]氧基]-N-(4-十四 烷氧苯基)-2-萘甲酰胺
- 中文别名
- 暂无
- 英文名
- 2-Naphthalenecarboxamide, 1-hydroxy-4-[[3-methyl-4-[[(5-methyl-1,3,4-oxadiazol-2-yl)thio]methyl]-1-phenyl-1H-pyrazol-5-yl]oxy]-N-[4-(tetradecyloxy)phenyl]-
- CAS
- 107703-70-8
- CID
- 14344729
- IUPAC 名称
- 1-hydroxy-4-[3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1-phenylpyrazol-5-yl]oxy-N-(4-tetradecoxyphenyl)naphthalene-2-carboxamide
名称与编号
- 中文名
- 1-羟基-4-[[3-甲基-4-[[(5-甲基 -1,3,4-恶二唑-2-基)硫代]-甲基-1- 苯基-1H-吡唑-5-基]氧基]-N-(4-十四 烷氧苯基)-2-萘甲酰胺
- 中文别名
- 暂无
- 英文名
- 2-Naphthalenecarboxamide, 1-hydroxy-4-[[3-methyl-4-[[(5-methyl-1,3,4-oxadiazol-2-yl)thio]methyl]-1-phenyl-1H-pyrazol-5-yl]oxy]-N-[4-(tetradecyloxy)phenyl]-
- CAS
- 107703-70-8
- CID
- 14344729
- IUPAC 名称
- 1-hydroxy-4-[3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1-phenylpyrazol-5-yl]oxy-N-(4-tetradecoxyphenyl)naphthalene-2-carboxamide
分子属性
- 分子式
- C45H53N5O5S
- 分子量
- 776 g/mol
- 精确质量
- 775.37674098 Da
- 单同位素质量
- 775.37674098 Da
- XLogP
- 13.6
- 极性表面积
- 150 Ų
- 氢键供体
- 2
- 氢键受体
- 9
- 可旋转键
- 22
- 重原子数
- 56
- 净电荷
- 0
- 结构复杂度
- 1110
结构标识
- InChIKey
- BJXBGDOWVVHOQF-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCCCCCCOC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=C(C(=NN4C5=CC=CC=C5)C)CSC6=NN=C(O6)C)O
- InChI
- InChI=1S/C45H53N5O5S/c1-4-5-6-7-8-9-10-11-12-13-14-20-29-53-36-27-25-34(26-28-36)46-43(52)39-30-41(37-23-18-19-24-38(37)42(39)51)55-44-40(31-56-45-48-47-33(3)54-45)32(2)49-50(44)35-21-16-15-17-22-35/h15-19,21-28,30,51H,4-14,20,29,31H2,1-3H3,(H,46,52)