SMILES:
CC(O)c1cc(Nc2nccc3nn(-c4c(Cl)cccc4Cl)cc23)ncn1Molecular Processing
Molecular formula
C18H14Cl2N6O
Molecular weight
401.26
Exact mass
400.0606
XLogP
4.31
TPSA
88.75
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
104.83
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 1 تفاعل→