CCCc1nc(C(C)(C)O)c(C(=O)OCOC(=O)C(C)(C)C)[nH]1
SMILES: CCCc1nc(C(C)(C)O)c(C(=O)OCOC(=O)C(C)(C)C)[nH]1

Molecular Processing

Molecular formula
C16H26N2O5
Molecular weight
326.39
Exact mass
326.1842
XLogP
2.29
TPSA
101.51
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.688
Molar refractivity
83.66

Supplementary Information

Details werden geladen…

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