Nom: 3-t-butyl-1-[4-(chloromethyl)naphthalen-2-yl]-1H-pyrazol-5-amine
SMILES:
CC(C)(C)c1cc(N)n(-c2cc(CCl)c3ccccc3c2)n1Molecular Processing
Molecular formula
C18H20ClN3
Molecular weight
313.83
Exact mass
313.1346
XLogP
4.64
TPSA
43.84
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
93.74
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→