4-phenylmethoxybenzenesulfonamide

C13H13NO3S — CID 19374444

IUPAC4-phenylmethoxybenzenesulfonamide
SMILESNS(=O)(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C13H13NO3S/c14-18(15,16)13-8-6-12(7-9-13)17-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,14,15,16)
InChIKeyAXTWZRIPELRWHW-UHFFFAOYSA-N
MW263.32 g/mol
LogP1.91
Rot. Bonds4

About 4-phenylmethoxybenzenesulfonamide

4-phenylmethoxybenzenesulfonamide (PubChem CID 19374444) has the molecular formula C13H13NO3S and a molecular weight of 263.32 g/mol. Its IUPAC name is 4-phenylmethoxybenzenesulfonamide.

Molecular Properties

Compound Name4-phenylmethoxybenzenesulfonamide
PubChem CID19374444
Molecular FormulaC13H13NO3S
Molecular Weight263.32 g/mol
Exact Mass263.06
IUPAC Name4-phenylmethoxybenzenesulfonamide
SMILESNS(=O)(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C13H13NO3S/c14-18(15,16)13-8-6-12(7-9-13)17-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,14,15,16)
InChIKeyAXTWZRIPELRWHW-UHFFFAOYSA-N
XLogP1.91
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-phenylmethoxybenzenesulfonamide?
The IUPAC name of 4-phenylmethoxybenzenesulfonamide (CID 19374444) is 4-phenylmethoxybenzenesulfonamide.
What is the SMILES notation for 4-phenylmethoxybenzenesulfonamide?
The canonical SMILES for 4-phenylmethoxybenzenesulfonamide is NS(=O)(=O)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 4-phenylmethoxybenzenesulfonamide?
The InChIKey is AXTWZRIPELRWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO3S/c14-18(15,16)13-8-6-12(7-9-13)17-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,14,15,16).
What are the key properties of 4-phenylmethoxybenzenesulfonamide?
4-phenylmethoxybenzenesulfonamide has a molecular weight of 263.32 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmethoxybenzenesulfonamide is sourced from PubChem (CID 19374444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).