SMILES:
C=CCOCCn1c(C(=O)C2CCNCC2)nc2ccccc21Molecular Processing
Molecular formula
C18H23N3O2
Molecular weight
313.4
Exact mass
313.179
XLogP
2.42
TPSA
56.15
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
90.67
Supplementary Information
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