SMILES:
O=C(CCl)NCCCOc1cc(CN2CCCCC2)ccn1Molecular Processing
Molecular formula
C16H24ClN3O2
Molecular weight
325.84
Exact mass
325.1557
XLogP
2.19
TPSA
54.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
87.21
Supplementary Information
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