$COC(=O)c1cc(/N=C(\Cl)C(F)(F)F)cc(-c2ccc(C)cc2)c1$

Nombre: 5-[1-chloro-2,2,2-trifluoro-eth-(Z)-ylideneamino]-4′-methyl-biphenyl-3-carboxylic acid methyl ester

SMILES: COC(=O)c1cc(/N=C(\Cl)C(F)(F)F)cc(-c2ccc(C)cc2)c1

Molecular Processing

Molecular formula

C17H13ClF3NO2

Molecular weight

355.74

Exact mass

355.0587

XLogP

5.28

TPSA

38.66

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.176

Molar refractivity

86.96

Supplementary Information

Obteniendo detalles…