Name: 1-(2-amino-4,6-dichloropyrimidin-5-yl)pent-4-en-1-ol
SMILES:
C=CCCC(O)c1c(Cl)nc(N)nc1ClMolecular Processing
Molecular formula
C9H11Cl2N3O
Molecular weight
248.11
Exact mass
247.0279
XLogP
2.37
TPSA
72.03
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
60.86
Supplementary Information
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