이름: 3-(6-tert-butoxycarbonylamino-pyridin-3-yl)-2-(diethoxyphosphoryl)-propionic acid ethyl ester
SMILES:
CCOC(=O)C(Cc1ccc(NC(=O)OC(C)(C)C)nc1)P(=O)(OCC)OCCMolecular Processing
Molecular formula
C19H31N2O7P
Molecular weight
430.44
Exact mass
430.1869
XLogP
4.17
TPSA
113.05
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
29
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
109.08
Supplementary Information
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