Name: (S)—N-{3-[(S)-4-(tert-butyl-dimethyl-silanyloxy)-6-aza-spiro[2.5]oct-6-yl]-propyl}-2-(4-chloro-3-trifluoromethoxy-phenylamino)-N-(2,2-dimethoxy-ethyl)-propionamide
SMILES:
COC(CN(CCCN1CCC2(CC2)[C@H](O[Si](C)(C)C(C)(C)C)C1)C(=O)[C@H](C)Nc1ccc(Cl)c(OC(F)(F)F)c1)OCMolecular Processing
Molecular formula
C30H49ClF3N3O5Si
Molecular weight
652.27
Exact mass
651.3082
XLogP
6.75
TPSA
72.5
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
43
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.767
Molar refractivity
165.02
Supplementary Information
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