名称: 2-{2-[1-(4-chloro-phenyl)-ethylideneamino-oxymethyl]-phenyl}-methylthioimino-acetic acid methyl ester
SMILES:
CC=NOC(c1ccc(Cl)cc1)c1ccccc1C(=NSC)C(=O)OCMolecular Processing
Molecular formula
C19H19ClN2O3S
Molecular weight
390.89
Exact mass
390.0805
XLogP
4.69
TPSA
60.25
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
26
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
0.211
Molar refractivity
107.06
Supplementary Information
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