SMILES:
CC(C)(C)OC(=O)N1C(Cc2ccc(NC(=O)Cc3csc(N)n3)c(Br)c2)CCC1C(O)c1ccccc1Molecular Processing
Molecular formula
C28H33BrN4O4S
Molecular weight
601.57
Exact mass
600.1406
XLogP
5.71
TPSA
117.78
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.393
Molar refractivity
152.99
Supplementary Information
Obteniendo detalles…
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