이름: 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoyloxymethyl carbonochloridate
SMILES:
NS(=O)(=O)c1cc(C(=O)OCOC(=O)Cl)c(NCc2ccco2)cc1ClMolecular Processing
Molecular formula
C14H12Cl2N2O7S
Molecular weight
423.23
Exact mass
421.9742
XLogP
2.68
TPSA
137.93
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
91.48
Supplementary Information
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