COC(=O)c1cnc(Cl)nc1C(F)(F)F
SMILES: COC(=O)c1cnc(Cl)nc1C(F)(F)F

Molecular Processing

Molecular formula
C7H4ClF3N2O2
Molecular weight
240.57
Exact mass
239.9913
XLogP
1.94
TPSA
52.08
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
43.38

Supplementary Information

詳細情報を取得中…

45 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→