O=C(c1ccc(CN2C(=O)CN(C(=O)c3ccc(Cl)cc3)Cc3ccccc32)cc1)N1CC=CC1
SMILES: O=C(c1ccc(CN2C(=O)CN(C(=O)c3ccc(Cl)cc3)Cc3ccccc32)cc1)N1CC=CC1

Molecular Processing

Molecular formula
C28H24ClN3O3
Molecular weight
485.97
Exact mass
485.1506
XLogP
4.54
TPSA
60.93
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.179
Molar refractivity
135.31

Supplementary Information

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