O=C(O)CC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2O)c2ccc(Cl)cc21
SMILES: O=C(O)CC1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2O)c2ccc(Cl)cc21

Molecular Processing

Molecular formula
C26H22Cl2N2O5
Molecular weight
513.38
Exact mass
512.0906
XLogP
5.95
TPSA
106.94
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
134.87

Supplementary Information

詳細情報を取得中…

3 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→