COC(=O)C(CN1C(=O)c2cccc(C)c2C1=O)C(C)=O
SMILES: COC(=O)C(CN1C(=O)c2cccc(C)c2C1=O)C(C)=O

Molecular Processing

Molecular formula
C15H15NO5
Molecular weight
289.29
Exact mass
289.095
XLogP
0.97
TPSA
80.75
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
72.73

Supplementary Information

詳細情報を取得中…

1 件の反応に参加