SMILES:
CC1(C)CC2(CC(C)(C)N1c1nc(Cl)nc(Cl)n1)OCCO2Molecular Processing
Molecular formula
C14H20Cl2N4O2
Molecular weight
347.25
Exact mass
346.0963
XLogP
3.08
TPSA
60.37
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
1
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.786
Molar refractivity
84.35
Supplementary Information
Récupération des détails…
Impliqué dans 6 réactions→