SMILES:
CC(C)(C)OC(=O)N1CCCCC1CCNCc1cccc(-c2ccnc(Cl)n2)c1Molecular Processing
Molecular formula
C23H31ClN4O2
Molecular weight
430.98
Exact mass
430.2136
XLogP
5.07
TPSA
67.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
119.38
Supplementary Information
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