COc1cc(C(F)(F)F)cc(C(F)(F)F)c1C(=O)NC(c1ccccc1)C1(N2CCCC2)COC1
SMILES: COc1cc(C(F)(F)F)cc(C(F)(F)F)c1C(=O)NC(c1ccccc1)C1(N2CCCC2)COC1

Molecular Processing

Molecular formula
C24H24F6N2O3
Molecular weight
502.46
Exact mass
502.1691
XLogP
5.07
TPSA
50.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
35
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
114

Supplementary Information

詳細情報を取得中…

2 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→