名称: methyl 3-(3,5-dibromo-2-oxopyrazin-1(2H)-yl)-4-ethylbenzoate
SMILES:
CCc1ccc(C(=O)OC)cc1-n1cc(Br)nc(Br)c1=OMolecular Processing
Molecular formula
C14H12Br2N2O3
Molecular weight
416.07
Exact mass
413.9215
XLogP
3.11
TPSA
61.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
85.95
Supplementary Information
詳細情報を取得中…
2 件の反応に参加→