CC(C)N(C[C@@H](C(=O)O)c1ccc(Cl)cc1)C(=O)OC(C)(C)C
Nom: (S)-3-(tert-butoxycarbonyl(isopropyl)amino)-2-(4-chlorophenyl)propanoic acid
SMILES: CC(C)N(C[C@@H](C(=O)O)c1ccc(Cl)cc1)C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C17H24ClNO4
Molecular weight
341.84
Exact mass
341.1394
XLogP
4.15
TPSA
66.84
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
89.9

Supplementary Information

Récupération des détails…

Impliqué dans 35 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→