Nombre: 1-[4-[2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl]phenyl]ethanone

SMILES: CC1=CC2=NC(=C3C(=C2C=C1)C=C(C=N3)CCC4=CC=C(C=C4)C(=O)C)N

Molecular Processing

Molecular formula

C23H21N3O

Molecular weight

355.44

Exact mass

355.1685

XLogP

4.66

TPSA

68.87

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

0.174

Molar refractivity

110.05

Supplementary Information

InChIKey: UKAPERUNRKIMOJ-UHFFFAOYSA-N

Sinónimos

SCHEMBL1007910UKAPERUNRKIMOJ-UHFFFAOYSA-N1-(4-(2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl)phenyl)ethanone