Nom: 3-[1-(4-Methoxy-benzyl)-2-oxo-piperidin-4-ylamino]-5-(1-methyl-hexa-1,3,5-trienyl)-thiophene-2-carboxylic acid methyl ester
SMILES:
C=CC=CC=C(C)c1cc(NC2CCN(Cc3ccc(OC)cc3)C(=O)C2)c(C(=O)OC)s1Molecular Processing
Molecular formula
C26H30N2O4S
Molecular weight
466.6
Exact mass
466.1926
XLogP
5.29
TPSA
67.87
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
133.7
Supplementary Information
Récupération des détails…
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