SMILES:
CC(c1noc(-c2cccc(Cl)c2)n1)N(C)c1nnc(-c2ccncc2)n1CMolecular Processing
Molecular formula
C19H18ClN7O
Molecular weight
395.85
Exact mass
395.1261
XLogP
3.78
TPSA
85.76
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
28
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
0.211
Molar refractivity
105.8
Supplementary Information
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