N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide

C20H18FNO3S — CID 89484220

IUPACN-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide
SMILESCc1ccc(F)cc1NS(=O)(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C20H18FNO3S/c1-15-7-8-17(21)13-20(15)22-26(23,24)19-11-9-18(10-12-19)25-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3
InChIKeyCASIWICWLLOOIO-UHFFFAOYSA-N
MW371.43 g/mol
LogP4.51
Rot. Bonds6

About N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide

N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide (PubChem CID 89484220) has the molecular formula C20H18FNO3S and a molecular weight of 371.43 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide
PubChem CID89484220
Molecular FormulaC20H18FNO3S
Molecular Weight371.43 g/mol
Exact Mass371.10
IUPAC NameN-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide
SMILESCc1ccc(F)cc1NS(=O)(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C20H18FNO3S/c1-15-7-8-17(21)13-20(15)22-26(23,24)19-11-9-18(10-12-19)25-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3
InChIKeyCASIWICWLLOOIO-UHFFFAOYSA-N
XLogP4.51
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.43
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide (CID 89484220) is N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide is Cc1ccc(F)cc1NS(=O)(=O)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide?
The InChIKey is CASIWICWLLOOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FNO3S/c1-15-7-8-17(21)13-20(15)22-26(23,24)19-11-9-18(10-12-19)25-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3.
What are the key properties of N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide?
N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide has a molecular weight of 371.43 g/mol, XLogP of 4.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-4-phenylmethoxybenzenesulfonamide is sourced from PubChem (CID 89484220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).