Nombre: 2-chloro-4-(1-ethyl-propylamino)-6-methyl-nicotinic acid
SMILES:
CCC(CC)Nc1cc(C)nc(Cl)c1C(=O)OMolecular Processing
Molecular formula
C12H17ClN2O2
Molecular weight
256.73
Exact mass
256.0979
XLogP
3.34
TPSA
62.22
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
68.94
Supplementary Information
Obteniendo detalles…
Participa en 10 reacciones→