الاسم: 4-fluoro-1,3-dihydro-isoindole-2-carboxylic acid (3R,5S)-1-tert-butoxycarbonyl-5-((1R,2S)-1-ethoxycarbonyl-2-vinyl-cyclopropylcarbamoyl)-pyrrolidin-3-yl ester
SMILES:
C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@H](OC(=O)N2Cc3cccc(F)c3C2)CN1C(=O)OC(C)(C)C)C(=O)OCCMolecular Processing
Molecular formula
C27H34FN3O7
Molecular weight
531.58
Exact mass
531.2381
XLogP
3.28
TPSA
114.48
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
38
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
133.07
Supplementary Information
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