이름: (R)-methyl 3-bromo-5-(2-(methoxymethyl)pyrrolidine-1-carbonyl)benzoate
SMILES:
COC[C@H]1CCCN1C(=O)c1cc(Br)cc(C(=O)OC)c1Molecular Processing
Molecular formula
C15H18BrNO4
Molecular weight
356.22
Exact mass
355.0419
XLogP
2.49
TPSA
55.84
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
81.42
Supplementary Information
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