COP(=O)(CCC(NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)Oc1cccc(CC(=O)OCc2ccccc2)c1
Name: benzyl 2-(N-benzyloxycarbonylamino)-4-{[3-(benzyloxycarbonylmethyl)phenyl](methyl)phosphono}butanoate
SMILES: COP(=O)(CCC(NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)Oc1cccc(CC(=O)OCc2ccccc2)c1

Molecular Processing

Molecular formula
C35H36NO9P
Molecular weight
645.65
Exact mass
645.2128
XLogP
6.62
TPSA
126.46
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
16
Heavy atoms
46
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.229
Molar refractivity
170.9

Supplementary Information

Details werden geladen…

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