N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide

C26H24N2O6S2 — CID 122220853

IUPACN-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide
SMILESCOc1cccc(NS(=O)(=O)c2ccccc2-c2ccccc2S(=O)(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C26H24N2O6S2/c1-33-21-11-7-9-19(17-21)27-35(29,30)25-15-5-3-13-23(25)24-14-4-6-16-26(24)36(31,32)28-20-10-8-12-22(18-20)34-2/h3-18,27-28H,1-2H3
InChIKeyIZNCAXAEAGCERF-UHFFFAOYSA-N
MW524.62 g/mol
LogP4.97
Rot. Bonds9

About N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide

N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide (PubChem CID 122220853) has the molecular formula C26H24N2O6S2 and a molecular weight of 524.62 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide
PubChem CID122220853
Molecular FormulaC26H24N2O6S2
Molecular Weight524.62 g/mol
Exact Mass524.11
IUPAC NameN-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide
SMILESCOc1cccc(NS(=O)(=O)c2ccccc2-c2ccccc2S(=O)(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C26H24N2O6S2/c1-33-21-11-7-9-19(17-21)27-35(29,30)25-15-5-3-13-23(25)24-14-4-6-16-26(24)36(31,32)28-20-10-8-12-22(18-20)34-2/h3-18,27-28H,1-2H3
InChIKeyIZNCAXAEAGCERF-UHFFFAOYSA-N
XLogP4.97
TPSA110.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500524.62
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-fluoro-2-methoxy-N-(3-methoxyphenyl)benzenesulfonamide
CID 17018087
5-amino-2-chloro-N-(3-methoxyphenyl)benzenesulfonamide
CID 29042708
N-(3-methoxyphenyl)-2,4,6-trimethylbenzenesulfonamide
CID 779111
4-chloro-N-(3-methoxyphenyl)benzenesulfonamide
CID 819759
3-N-(3-methoxyphenyl)benzene-1,3-disulfonamide
CID 31064512
2,5-dimethoxy-N-(3-phenylmethoxyphenyl)benzenesulfonamide
CID 3770079
3,4-dichloro-N-(3-methoxyphenyl)benzenesulfonamide
CID 7745694
5-amino-2-chloro-4-fluoro-N-(3-methoxyphenyl)benzenesulfonamide
CID 61112072
N-(3-methoxyphenyl)-3-phenyl-1-propan-2-ylpyrazole-4-sulfonamide
CID 42284905
5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62144727
8-hydroxy-N-(3-methoxyphenyl)quinoline-4-sulfonamide
CID 11158687
3-methoxy-N-(3-methylphenyl)benzenesulfonamide
CID 889782

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide?
The IUPAC name of N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide (CID 122220853) is N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide is COc1cccc(NS(=O)(=O)c2ccccc2-c2ccccc2S(=O)(=O)Nc2cccc(OC)c2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide?
The InChIKey is IZNCAXAEAGCERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O6S2/c1-33-21-11-7-9-19(17-21)27-35(29,30)25-15-5-3-13-23(25)24-14-4-6-16-26(24)36(31,32)28-20-10-8-12-22(18-20)34-2/h3-18,27-28H,1-2H3.
What are the key properties of N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide?
N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide has a molecular weight of 524.62 g/mol, XLogP of 4.97, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide is sourced from PubChem (CID 122220853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).