Nom: 1,3-Dipropyl-7-pyrrolidin-1-ylmethyl-3,7-dihydro-purine-2,6-dione
SMILES:
CCCn1c(=O)c2c(ncn2CN2CCCC2)n(CCC)c1=OMolecular Processing
Molecular formula
C16H25N5O2
Molecular weight
319.41
Exact mass
319.2008
XLogP
1.23
TPSA
65.06
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.688
Molar refractivity
89.64
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→