N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide

C20H19NO5S — CID 46764272

IUPACN-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c(OC)c1
InChIInChI=1S/C20H19NO5S/c1-24-17-10-13-19(20(14-17)25-2)21-27(22,23)18-11-8-16(9-12-18)26-15-6-4-3-5-7-15/h3-14,21H,1-2H3
InChIKeyMVLLGLARKNNQPN-UHFFFAOYSA-N
MW385.44 g/mol
LogP4.30
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide

N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide (PubChem CID 46764272) has the molecular formula C20H19NO5S and a molecular weight of 385.44 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide
PubChem CID46764272
Molecular FormulaC20H19NO5S
Molecular Weight385.44 g/mol
Exact Mass385.10
IUPAC NameN-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c(OC)c1
InChIInChI=1S/C20H19NO5S/c1-24-17-10-13-19(20(14-17)25-2)21-27(22,23)18-11-8-16(9-12-18)26-15-6-4-3-5-7-15/h3-14,21H,1-2H3
InChIKeyMVLLGLARKNNQPN-UHFFFAOYSA-N
XLogP4.30
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.44
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-bromo-2-phenoxyphenyl)-4-methoxybenzenesulfonamide
CID 68974633
4-(benzenesulfonamido)-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]benzamide
CID 126415575
4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide
CID 7940687
2-amino-N-(2,4-dimethoxyphenyl)benzenesulfonamide
CID 28590092
N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide
CID 823335
4-(benzenesulfonamido)-2-chloro-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]benzamide
CID 43885917
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-phenoxybenzenesulfonamide
CID 28579503
N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 7586552
N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
CID 167861168
(2-methoxy-4-phenoxyphenyl)hydrazine
CID 118138218
N-(2,4-dimethoxyphenyl)-4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]benzenesulfonamide
CID 168538130
N-[2-methoxy-5-[(2-phenoxyphenyl)sulfamoyl]phenyl]acetamide
CID 71903158

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide (CID 46764272) is N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide is COc1ccc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide?
The InChIKey is MVLLGLARKNNQPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO5S/c1-24-17-10-13-19(20(14-17)25-2)21-27(22,23)18-11-8-16(9-12-18)26-15-6-4-3-5-7-15/h3-14,21H,1-2H3.
What are the key properties of N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide?
N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide has a molecular weight of 385.44 g/mol, XLogP of 4.30, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide is sourced from PubChem (CID 46764272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).