Name: (S)-tert-butyl 2,2,4-trimethyl-4-(2-(4-(octyloxy)-3-(trifluoromethyl)-benzoyl)hydrazinecarbonyl)oxazolidine-3-carboxylate
SMILES:
CCCCCCCCOc1ccc(C(=O)NNC(=O)[C@]2(C)COC(C)(C)N2C(=O)OC(C)(C)C)cc1C(F)(F)FMolecular Processing
Molecular formula
C28H42F3N3O6
Molecular weight
573.65
Exact mass
573.3026
XLogP
5.97
TPSA
106.2
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
40
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.679
Molar refractivity
142.43
Supplementary Information
Details werden geladen…
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