Name: 5-iodo-7-[(1R)-1-methyl-2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-7H-pyrrolo[2,3-d]pyrimidine
SMILES:
C[C@H](COC1CCCCO1)n1cc(I)c2cncnc21Molecular Processing
Molecular formula
C14H18IN3O2
Molecular weight
387.22
Exact mass
387.0444
XLogP
3.14
TPSA
49.17
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
84.5
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→