SMILES:
CCCc1nc(C)n(-c2ccc(OC3CCCCC3O)cc2)c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1Molecular Processing
Molecular formula
C34H35N3O3
Molecular weight
533.67
Exact mass
533.2678
XLogP
6.31
TPSA
88.14
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
40
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.324
Molar refractivity
156.86
Supplementary Information
Obteniendo detalles…
Participa en 1 reacciones→