SMILES:
O=c1cnn(-c2ccc(C(Cl)c3ccc(Cl)cc3Cl)c(Cl)c2)c(=O)[nH]1Molecular Processing
Molecular formula
C16H9Cl4N3O2
Molecular weight
417.08
Exact mass
414.9449
XLogP
4.21
TPSA
67.75
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
99.62
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 7 تفاعل→