Название: N—[(S)-5-(2-benzyloxy-ethyl)-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl]-2-fluoro-2-methyl-N′-(2,2,3,3,3-pentafluoro-propyl)-malonamide
SMILES:
CC(F)(C(=O)NCC(F)(F)C(F)(F)F)C(=O)N[C@@H]1C(=O)N(CCOCc2ccccc2)c2ccccc2-c2ccccc21Molecular Processing
Molecular formula
C30H27F6N3O4
Molecular weight
607.55
Exact mass
607.1906
XLogP
5.12
TPSA
87.74
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
43
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
144.74
Supplementary Information
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