Nombre: (S)-benzyl 4-(tert-butoxycarbonylamino)-5-((R)-1-(1-hydroxy-3,3-dimethyl-1,3-dihydrobenzo[c][1,2]oxaborol-6-ylamino)-1-oxo-4-(4-(trifluoromethyl)phenyl)butan-2-ylamino)-5-oxopentanoate
SMILES:
CC(C)(C)OC(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)N[C@H](CCc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)B(O)OC2(C)CMolecular Processing
Molecular formula
C37H43BF3N3O8
Molecular weight
725.57
Exact mass
725.3095
XLogP
5.13
TPSA
152.29
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
13
Heavy atoms
52
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.405
Molar refractivity
187.11
Supplementary Information
Obteniendo detalles…
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