Name: 3-{N-[β-(3,4-diacetoxyphenyl)ethyl]}carbamoylpyridine
SMILES:
CC(=O)Oc1ccc(CCNC(=O)c2cccnc2)cc1OC(C)=OMolecular Processing
Molecular formula
C18H18N2O5
Molecular weight
342.35
Exact mass
342.1216
XLogP
1.9
TPSA
94.59
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
89.33
Supplementary Information
Details werden geladen…
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