NC(=O)C1(c2ccccc2CCc2nc(Nc3ccc(C4CNC4)cc3)ncc2C(F)(F)F)CC1
SMILES: NC(=O)C1(c2ccccc2CCc2nc(Nc3ccc(C4CNC4)cc3)ncc2C(F)(F)F)CC1

Molecular Processing

Molecular formula
C26H26F3N5O
Molecular weight
481.52
Exact mass
481.2089
XLogP
4.23
TPSA
92.93
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
126.33

Supplementary Information

詳細情報を取得中…

1 件の反応に参加