Nombre: ethyl 4-chloro-5H-pyrrolo[3,4-b]pyridine-6(7H)-carboxylate
SMILES:
CCOC(=O)N1Cc2nccc(Cl)c2C1Molecular Processing
Molecular formula
C10H11ClN2O2
Molecular weight
226.66
Exact mass
226.0509
XLogP
2.21
TPSA
42.43
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
55.52
Supplementary Information
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