Nombre: methyl 3-(4-chlorobenzoylamino)-3-(3-thienylcarbonyl)propionate
SMILES:
COC(=O)CC(NC(=O)c1ccc(Cl)cc1)C(=O)c1ccsc1Molecular Processing
Molecular formula
C16H14ClNO4S
Molecular weight
351.81
Exact mass
351.0332
XLogP
2.95
TPSA
72.47
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
87.99
Supplementary Information
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