Nombre: N-[benzyl-[[4-(hydroxymethyl)cyclohexyl]methyl]sulfamoyl]-3,5-bis(trifluoromethyl)benzamide

SMILES: O=C(NS(=O)(=O)N(Cc1ccccc1)CC1CCC(CO)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

Molecular Processing

Molecular formula

C24H26F6N2O4S

Molecular weight

552.54

Exact mass

552.1517

XLogP

TPSA

86.71

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

0.458

Molar refractivity

122.22

Supplementary Information

InChIKey: VQGBZLSUHPLVKB-UHFFFAOYSA-N

Sinónimos

N-benzyl-N'-[3,5-bis(trifluoromethyl)benzoyl]-N-{[4-(hydroxymethyl)cyclohexyl]methyl}sulfamideSCHEMBL6387308VQGBZLSUHPLVKB-IYARVYRRSA-N