Name: tert-butyl 1-(2-hydroxy-2-(4-(N′-hydroxycarbamimidoyl)phenyl)ethyl)azetidine-3-carboxylate
SMILES:
CC(C)(C)OC(=O)C1CN(CC(O)c2ccc(C(N)=NO)cc2)C1Molecular Processing
Molecular formula
C17H25N3O4
Molecular weight
335.4
Exact mass
335.1845
XLogP
1.09
TPSA
108.38
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
89.69
Supplementary Information
Details werden geladen…
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