Name: Compound 6a
SMILES:
COC(=O)c1ccc(-c2c(/C=C/c3ccc4ccccc4n3)nc3c(N4CCOCC4)ccnn23)cc1OMolecular Processing
Molecular formula
C29H25N5O4
Molecular weight
507.55
Exact mass
507.1907
XLogP
4.44
TPSA
102.08
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
38
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.172
Molar refractivity
145.13
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→