Название: 3-[2-chloro-4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]-2-ethoxypropanoic acid

SMILES: CCOC(CC1=C(C=C(C=C1)OCC2=C(OC(=N2)C3=CC=CC=C3)C)Cl)C(=O)O

Molecular Processing

Molecular formula

C22H22ClNO5

Molecular weight

415.87

Exact mass

415.1187

XLogP

4.91

TPSA

81.79

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

0.273

Molar refractivity

109.21

Supplementary Information

InChIKey: WNMGSZWOHFNYLU-UHFFFAOYSA-N

Синонимы

SCHEMBL5017395