이름: N-((4aS*,5R*,7aS*)-7a-(2,4-Difluorophenyl)-5-methyl-4a,5,7,7a-tetrahydro-4H-furo[3,4-d][1,3]thiazin-2-yl)benzamide
SMILES:
C[C@H]1OC[C@]2(c3ccc(F)cc3F)N=C(NC(=O)c3ccccc3)SC[C@H]12Molecular Processing
Molecular formula
C20H18F2N2O2S
Molecular weight
388.44
Exact mass
388.1057
XLogP
3.73
TPSA
50.69
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
100.74
Supplementary Information
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