SMILES:
Cc1cccc2c1c(Cn1c(=O)n(C(C(=O)O)C3CCCCC3)c(=O)c3ccccc31)cn2CMolecular Processing
Molecular formula
C27H29N3O4
Molecular weight
459.55
Exact mass
459.2158
XLogP
4.22
TPSA
86.23
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.37
Molar refractivity
132.47
Supplementary Information
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