Name: thenylchlor
SMILES:
COc1ccsc1CN(C(=O)CCl)c1c(C)cccc1CMolecular Processing
Molecular formula
C16H18ClNO2S
Molecular weight
323.85
Exact mass
323.0747
XLogP
4.15
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
88.7
Supplementary Information
Details werden geladen…
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