N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide

C21H20N2O6S — CID 75452209

IUPACN-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1cc(O)cc(NC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)c1
InChIInChI=1S/C21H20N2O6S/c1-28-17-12-15(11-16(24)13-17)22-21(25)14-6-5-7-18(10-14)30(26,27)23-19-8-3-4-9-20(19)29-2/h3-13,23-24H,1-2H3,(H,22,25)
InChIKeyYDQSTUXXPHIDLZ-UHFFFAOYSA-N
MW428.47 g/mol
LogP3.46
Rot. Bonds7

About N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide

N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide (PubChem CID 75452209) has the molecular formula C21H20N2O6S and a molecular weight of 428.47 g/mol. Its IUPAC name is N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
PubChem CID75452209
Molecular FormulaC21H20N2O6S
Molecular Weight428.47 g/mol
Exact Mass428.10
IUPAC NameN-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1cc(O)cc(NC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)c1
InChIInChI=1S/C21H20N2O6S/c1-28-17-12-15(11-16(24)13-17)22-21(25)14-6-5-7-18(10-14)30(26,27)23-19-8-3-4-9-20(19)29-2/h3-13,23-24H,1-2H3,(H,22,25)
InChIKeyYDQSTUXXPHIDLZ-UHFFFAOYSA-N
XLogP3.46
TPSA113.96 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.47
LogP ≤ 53.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
3-methoxy-N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 2449372
N-(3-cyanophenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 9164272
3-(tert-butylsulfamoyl)-N-(3,5-dimethoxyphenyl)benzamide
CID 9096794
3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide
CID 51185857
N-[(Z)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 136772598
N-[3-(3-cyanopropoxy)phenyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 55960868
3-[(2-methoxyphenyl)sulfamoyl]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 29370167
3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide
CID 75468512
3-[(cyclopropanecarbonylamino)carbamoyl]-N-(2-methoxyphenyl)benzenesulfonamide
CID 2666822
propan-2-yl 3-[(2-methoxyphenyl)sulfamoyl]benzoate
CID 35468470
3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 51163765

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide (CID 75452209) is N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide is COc1cc(O)cc(NC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)c1.
What is the InChIKey of N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The InChIKey is YDQSTUXXPHIDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O6S/c1-28-17-12-15(11-16(24)13-17)22-21(25)14-6-5-7-18(10-14)30(26,27)23-19-8-3-4-9-20(19)29-2/h3-13,23-24H,1-2H3,(H,22,25).
What are the key properties of N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide has a molecular weight of 428.47 g/mol, XLogP of 3.46, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 75452209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).