الاسم: title compound
SMILES:
C=CCCCCC[C@H](NC(=O)c1cnc(C)nc1)C(=O)OMolecular Processing
Molecular formula
C15H21N3O3
Molecular weight
291.35
Exact mass
291.1583
XLogP
2.1
TPSA
92.18
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
78.94
Supplementary Information
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