Name: 4-tert-butyl-N-[4-chloro-2-(2-chloropyridine-4-carbonyl)phenyl]benzenesulfonamide

SMILES: CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC(=NC=C3)Cl

Molecular Processing

Molecular formula

C22H20Cl2N2O3S

Molecular weight

463.39

Exact mass

462.0572

XLogP

5.72

TPSA

76.13

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

0.182

Molar refractivity

120.08

Supplementary Information

InChIKey: HHIFURJBSOMROQ-UHFFFAOYSA-N

Synonyme

SCHEMBL344369CHEMBL3717222HHIFURJBSOMROQ-UHFFFAOYSA-N4-tert-Butyl-N-[4-chloro-2-(2-chloro-pyridine-4-carbonyl)-phenyl]-benzenesulfonamide