Название: (5S,7S)-7-(2-chloro-5-fluoropyrimidin-4-ylamino)-3-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
SMILES:
CN1C[C@@]2(CCC[C@H](Nc3nc(Cl)ncc3F)C2)OC1=OMolecular Processing
Molecular formula
C13H16ClFN4O2
Molecular weight
314.75
Exact mass
314.0946
XLogP
2.44
TPSA
67.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
74.72
Supplementary Information
Загрузка подробностей…
Участвует в 2 реакциях→