CCOP(=O)(OCC)c1ccc(-c2ccc(C(C)(C)NC(=O)OC(C)(C)C)cn2)cc1
Name: tert-butyl 2-(6-(4-(diethoxyphosphoryl)phenyl)pyridin-3-yl)propan-2-ylcarbamate
SMILES: CCOP(=O)(OCC)c1ccc(-c2ccc(C(C)(C)NC(=O)OC(C)(C)C)cn2)cc1

Molecular Processing

Molecular formula
C23H33N2O5P
Molecular weight
448.5
Exact mass
448.2127
XLogP
5.4
TPSA
86.75
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
31
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.478
Molar refractivity
122.56

Supplementary Information

Details werden geladen…

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