Название: methyl 2-({[(trichloroacetyl)amino]carbonyl}amino)thiophene-3-carboxylate
SMILES:
COC(=O)c1ccsc1NC(=O)NC(=O)C(Cl)(Cl)ClMolecular Processing
Molecular formula
C9H7Cl3N2O4S
Molecular weight
345.59
Exact mass
343.9192
XLogP
2.55
TPSA
84.5
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
73.11
Supplementary Information
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