Name: N-(4,6-dichloro-2-methylsulfanyl-pyrimidin-5-yl)-2-(2,6-dichloro-phenyl)-acetamide
SMILES:
CSc1nc(Cl)c(NC(=O)Cc2c(Cl)cccc2Cl)c(Cl)n1Molecular Processing
Molecular formula
C13H9Cl4N3OS
Molecular weight
397.11
Exact mass
394.922
XLogP
4.99
TPSA
54.88
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
92.63
Supplementary Information
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