Nom: (E)-3-{3,4-Dihydro-4-oxo-spiro[2H-(1,3)-benzoxazine-2,4′-piperidin]-6-yl}-acrylic acid methyl ester hydrochloride
SMILES:
COC(=O)/C=C/c1ccc2c(c1)C(=O)NC1(CCNCC1)O2.ClMolecular Processing
Molecular formula
C16H19ClN2O4
Molecular weight
338.79
Exact mass
338.1033
XLogP
1.5
TPSA
76.66
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
23
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.375
Molar refractivity
87.67
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→