CCOC1CC(S(=O)(=O)c2ccc(-c3c(C)noc3C)cc2C(F)(F)F)CC1C(=O)NC1(C#N)CC1
SMILES: CCOC1CC(S(=O)(=O)c2ccc(-c3c(C)noc3C)cc2C(F)(F)F)CC1C(=O)NC1(C#N)CC1

Molecular Processing

Molecular formula
C24H26F3N3O5S
Molecular weight
525.55
Exact mass
525.1545
XLogP
4.11
TPSA
122.29
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
36
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.542
Molar refractivity
121.25

Supplementary Information

詳細情報を取得中…

1 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→