MDL | MFCD32062689 |
---|---|
InChIKey | SKDNDJWEBPQKCS-RIQBOWGZSA-N |
Inchi | 1S/C30H32F2N4O3/c1-17-29(18(2)39-34-17)19-7-14-26-25(15-19)33-30(36(26)20-8-11-22(38-3)12-9-20)27-5-4-6-28(37)35(27)21-10-13-23(31)24(32)16-21/h7,10,13-16,20,22,27H,4-6,8-9,11-12H2,1-3H3/t20?,22?,27-/m0/s1 |
SMILES | FC1=C(C([H])=C([H])C(=C1[H])N1C(C([H])([H])C([H])([H])C([H])([H])[C@@]1([H])C1=NC2C([H])=C(C3C(C([H])([H])[H])=NOC=3C([H])([H])[H])C([H])=C([H])C=2N1C1([H])C([H])([H])C([H])([H])C([H])(C([H])([H])C1([H])[H])OC([H])([H])[H])=O)F |
氢键供体数量 | 0 |
---|---|
氢键受体数量 | 7 |
可旋转化学键数量 | 5 |
重原子数量 | 39 |
复杂度 | 860 |
拓扑分子极性表面积 | 73.4 |