Name: compound 32
SMILES:
Clc1ncc(Br)c(NC2CCOCC2)n1Molecular Processing
Molecular formula
C9H11BrClN3O
Molecular weight
292.56
Exact mass
290.9774
XLogP
2.48
TPSA
47.04
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
62.21
Supplementary Information
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Involved in 8 reactions→