C[C@@H]1N[C@@H]([C@H](OCc2ccccc2)[C@H](Cc2cc(F)cc(F)c2)N(Cc2ccccc2)Cc2ccccc2)COC1O
الاسم: (3S,5R)-5-[(1S,2S)-2-(dibenzylamino)-3-(3,5-difluorophenyl)-1-phenylmethoxypropyl]-3-methylmorpholin-2-ol
SMILES: C[C@@H]1N[C@@H]([C@H](OCc2ccccc2)[C@H](Cc2cc(F)cc(F)c2)N(Cc2ccccc2)Cc2ccccc2)COC1O

Molecular Processing

Molecular formula
C35H38F2N2O3
Molecular weight
572.7
Exact mass
572.285
XLogP
5.86
TPSA
53.96
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
12
Heavy atoms
42
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.314
Molar refractivity
159.34

Supplementary Information

InChIKey: HEHIOTMQUYHFDY-DUJWSFIZSA-N
مرادفات
SCHEMBL3237261HEHIOTMQUYHFDY-DUJWSFIZSA-N(2RS,3S,5R)-5-[(1S,2S)-1-benzyloxy-2-dibenzylamino-3-(3,5-difluorophenyl)-propyl]-3-methylmorpholin-2-ol(3S,5R)-5-[(1S,2S)-1-benzyloxy-2-dibenzylamino-3-(3,5-difluorophenyl)-propyl]-3-methylmorpholin-2-ol
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