Name: N-({4′-[(1-benzofuran-2-ylcarbonyl)amino]-1,1′-biphenyl-4-yl}sulfonyl)-L-valine t-butyl ester
SMILES:
CC(C)[C@H](NS(=O)(=O)c1ccc(-c2ccc(NC(=O)c3cc4ccccc4o3)cc2)cc1)C(=O)OC(C)(C)CMolecular Processing
Molecular formula
C30H32N2O6S
Molecular weight
548.66
Exact mass
548.1981
XLogP
6
TPSA
114.71
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
39
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
150.84
Supplementary Information
Details werden geladen…
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