Название: (R)-4-(3-{(S)-2-[4-(2-chloro-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-4-methyl-pentanoylamino}-pyrazol-1-ylmethyl)-2,2-dimethyl-oxazolidin-3-carboxylic acid t-butyl ester
SMILES:
CC(C)C[C@@H](C(=O)Nc1ccn(C[C@@H]2COC(C)(C)N2C(=O)OC(C)(C)C)n1)N1CC(Oc2ccccc2Cl)=CC1=OMolecular Processing
Molecular formula
C30H40ClN5O6
Molecular weight
602.13
Exact mass
601.2667
XLogP
5.07
TPSA
115.23
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
42
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
157.87
Supplementary Information
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