Name: t-butyl 4-[3-(4-thiocarbamoylbenzoyl)ureido]-2-(t-butoxymethoxy)phenoxyacetate
SMILES:
CC(C)(C)OCOc1cc(NC(=O)NC(=O)c2ccc(C(N)=S)cc2)ccc1OCC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C26H33N3O7S
Molecular weight
531.63
Exact mass
531.2039
XLogP
4.15
TPSA
138.21
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
37
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
142.93
Supplementary Information
Details werden geladen…
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