C[C@@H]1CCCN[C@@H]1CNc1nc2cc(Cl)ccc2o1
Nom: 5-chloro-N-(((2S,3R)-3-methylpiperidin-2-yl)methyl)benzo[d]oxazol-2-amine
SMILES: C[C@@H]1CCCN[C@@H]1CNc1nc2cc(Cl)ccc2o1

Molecular Processing

Molecular formula
C14H18ClN3O
Molecular weight
279.77
Exact mass
279.1138
XLogP
3.28
TPSA
50.09
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
77.7

Supplementary Information

Récupération des détails…

Impliqué dans 16 réactions