Name: 4-allyl-1-(1-benzyloxycarbonyl-1-triphenylphosphoranylidenemethyl)-3-(2-hydroxy-2-propyl)azetidin-2-one
SMILES:
C=CCC1C(C(C)(C)O)C(=O)N1C(C(=O)OCc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C36H36NO4P
Molecular weight
577.66
Exact mass
577.2382
XLogP
5.03
TPSA
66.84
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
42
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.194
Molar refractivity
171.63
Supplementary Information
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