SMILES:
COc1cc([N+](=O)[O-])ccc1OCCCN1CCN(c2cc(=O)n(C)c(=O)n2C)CC1Molecular Processing
Molecular formula
C20H27N5O6
Molecular weight
433.47
Exact mass
433.1961
XLogP
0.59
TPSA
112.08
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
115.34
Supplementary Information
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