SMILES:
CCCc1nc2c(C(=O)O)cccc2n1Cc1ccc2c(c1)COc1ccccc1C2=C(C)C#NMolecular Processing
Molecular formula
C29H25N3O3
Molecular weight
463.54
Exact mass
463.1896
XLogP
5.97
TPSA
88.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.207
Molar refractivity
134.31
Supplementary Information
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Involved in 2 reactions→