Name: base ( XI )
SMILES:
CC(C)(C)OC(=O)C1=C(Cc2ccc(F)cc2)CS[C@@H]2C(N)C(=O)N12Molecular Processing
Molecular formula
C18H21FN2O3S
Molecular weight
364.44
Exact mass
364.1257
XLogP
2.21
TPSA
72.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
25
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
94.04
Supplementary Information
Details werden geladen…
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