SMILES:
CC(C)(C)OC(=O)NC(Cc1ccc([N+](=O)[O-])cc1)C(N)=SMolecular Processing
Molecular formula
C14H19N3O4S
Molecular weight
325.39
Exact mass
325.1096
XLogP
2.32
TPSA
107.49
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
86.74
Supplementary Information
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