SMILES:
CCc1ccccc1Nc1c(C(N)=O)cnc2cc(OCCN3CCNCC3)c(OC)cc12Molecular Processing
Molecular formula
C25H31N5O3
Molecular weight
449.56
Exact mass
449.2427
XLogP
2.93
TPSA
101.74
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
130.72
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→