O=C(O)c1cc(S(=O)(=O)NCC2CC2)ccc1Cl
SMILES: O=C(O)c1cc(S(=O)(=O)NCC2CC2)ccc1Cl

Molecular Processing

Molecular formula
C11H12ClNO4S
Molecular weight
289.74
Exact mass
289.0176
XLogP
1.73
TPSA
83.47
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
66.32

Supplementary Information

詳細情報を取得中…

8 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→