SMILES:
CC(C)NC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCCCCl)cc3n2C2CCC2)cc1Molecular Processing
Molecular formula
C26H29ClN4O2
Molecular weight
465
Exact mass
464.1979
XLogP
6.44
TPSA
79.08
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
133.1
Supplementary Information
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