Name: 2-amino-5-(4-chlorophenoxy)-4-(4-oxocyclohexylamino)pyrimidine
SMILES:
Nc1ncc(Oc2ccc(Cl)cc2)c(NC2CCC(=O)CC2)n1Molecular Processing
Molecular formula
C16H17ClN4O2
Molecular weight
332.79
Exact mass
332.104
XLogP
3.43
TPSA
90.13
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
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
0.312
Molar refractivity
88.86
Supplementary Information
Details werden geladen…
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