이름: (RS)—N-(4-benzyloxy-phenyl)-2,4-dibromo-butyramide
SMILES:
O=C(Nc1ccc(OCc2ccccc2)cc1)C(Br)CCBrMolecular Processing
Molecular formula
C17H17Br2NO2
Molecular weight
427.14
Exact mass
424.9626
XLogP
4.75
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
96.97
Supplementary Information
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