Nom: 7-[(acetoxy)(5-methyl-1-trityl-1H-imidazol-4-yl)methyl]-10-ethyl-8,9-dihydropyrido[1,2-a]-indol-6(7H)-one
SMILES:
CCc1c2n(c3ccccc13)C(=O)C(C(OC(C)=O)c1ncn(C(c3ccccc3)(c3ccccc3)c3ccccc3)c1C)CC2Molecular Processing
Molecular formula
C40H37N3O3
Molecular weight
607.75
Exact mass
607.2835
XLogP
8.06
TPSA
66.12
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
46
Rings
7
Aromatic rings
6
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.225
Molar refractivity
179.83
Supplementary Information
Récupération des détails…
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