CC1=C(C=NC=C1)N2CCN(C2=O)C3=CC(=C(C=C3)C=O)F
名称: 2-fluoro-4-[3-(4-methyl-3-pyridinyl)-2-oxoimidazolidin-1-yl]benzaldehyde
SMILES: CC1=C(C=NC=C1)N2CCN(C2=O)C3=CC(=C(C=C3)C=O)F

Molecular Processing

Molecular formula
C16H14FN3O2
Molecular weight
299.31
Exact mass
299.107
XLogP
2.79
TPSA
53.51
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
80.85

Supplementary Information

InChIKey: SKCZHWFPCONQQL-UHFFFAOYSA-N
同義語
SCHEMBL3786996SKCZHWFPCONQQL-UHFFFAOYSA-N2-Fluoro-4-[3-(4-methyl-pyridin-3-yl)-2-oxo-imidazolidin-1-yl]-benzaldehyde
出典を見る →
15 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→