Name: [1-benzyl-5-(1-propan-2-ylpiperidin-4-yl)oxyindol-2-yl]-morpholin-4-ylmethanone

SMILES: CC(C)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(=C3)C(=O)N4CCOCC4)CC5=CC=CC=C5

Molecular Processing

Molecular formula

C28H35N3O3

Molecular weight

461.61

Exact mass

461.2678

XLogP

4.41

TPSA

46.94

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

0.464

Molar refractivity

134.56

Supplementary Information

InChIKey: XJACEHMOPKCMMV-UHFFFAOYSA-N

Synonyms

SCHEMBL1397928XJACEHMOPKCMMV-UHFFFAOYSA-N[1-Benzyl-5-(1-isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]-morpholin-4-yl-methanone