SMILES:
CCOC(=O)C(Cl)c1nc2ccc(C)cn2c1NC1CCCCC1Molecular Processing
Molecular formula
C18H24ClN3O2
Molecular weight
349.86
Exact mass
349.1557
XLogP
4.23
TPSA
55.63
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
95.65
Supplementary Information
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