Name: 8-(4-chloro-6-morpholino-1,3,5-triazin-2-yl)-3-oxa-8-azabicyclo[3,2,1]octane
SMILES:
Clc1nc(N2CCOCC2)nc(N2C3CCC2COC3)n1Molecular Processing
Molecular formula
C13H18ClN5O2
Molecular weight
311.77
Exact mass
311.1149
XLogP
0.73
TPSA
63.61
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
2
Heavy atoms
21
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.769
Molar refractivity
77.98
Supplementary Information
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