Nom: 4-[3-(3-butyl-8-azabicyclo[3.2.1]octan-8-yl)-2-methylpropyl]-1,4-benzothiazin-3-one

SMILES: CCCCC1CC2CCC(C1)N2CC(C)CN3C(=O)CSC4=CC=CC=C43

Molecular Processing

Molecular formula

C23H34N2OS

Molecular weight

386.61

Exact mass

386.2392

XLogP

5.19

TPSA

23.55

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

0.696

Molar refractivity

114.45

Supplementary Information

InChIKey: FKGNEHONLNMRPP-UHFFFAOYSA-N

Synonymes

SCHEMBL4097747