SMILES:
CCOC(=O)c1ccc(-n2ccnc2C(CC)CC)c([N+](=O)[O-])c1Molecular Processing
Molecular formula
C17H21N3O4
Molecular weight
331.37
Exact mass
331.1532
XLogP
3.86
TPSA
87.26
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
89.5
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→