CCOC(=O)C(Cl)=Cc1cc(NC(=O)C2=C(C(N)=O)CCCC2)ccc1Cl
SMILES: CCOC(=O)C(Cl)=Cc1cc(NC(=O)C2=C(C(N)=O)CCCC2)ccc1Cl

Molecular Processing

Molecular formula
C19H20Cl2N2O4
Molecular weight
411.29
Exact mass
410.08
XLogP
3.78
TPSA
98.49
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
27
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
105.23

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→