Name: 2-[(3S,4R)-4-(benzthiazol-2-yldithio)-3-phenoxyacetoxy-2-oxoazetidin-1-yl]-3-methylenebutyric acid methyl ester
SMILES:
C=C(C)C(C(=O)OC)N1C(=O)[C@H](OC(=O)COc2ccccc2)[C@H]1SSc1nc2ccccc2s1Molecular Processing
Molecular formula
C24H22N2O6S3
Molecular weight
530.65
Exact mass
530.064
XLogP
4.31
TPSA
95.03
H-bond donors
0
H-bond acceptors
10
Rotatable bonds
10
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
136.14
Supplementary Information
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Involved in 1 reactions→