N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide

C21H20N2O5S — CID 7553556

IUPACN-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3cccc(OC)c3)cc2)cc1
InChIInChI=1S/C21H20N2O5S/c1-27-18-10-12-20(13-11-18)29(25,26)23-16-8-6-15(7-9-16)21(24)22-17-4-3-5-19(14-17)28-2/h3-14,23H,1-2H3,(H,22,24)
InChIKeyKFQLPORQQFQDON-UHFFFAOYSA-N
MW412.47 g/mol
LogP3.76
Rot. Bonds7

About N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide

N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide (PubChem CID 7553556) has the molecular formula C21H20N2O5S and a molecular weight of 412.47 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
PubChem CID7553556
Molecular FormulaC21H20N2O5S
Molecular Weight412.47 g/mol
Exact Mass412.11
IUPAC NameN-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3cccc(OC)c3)cc2)cc1
InChIInChI=1S/C21H20N2O5S/c1-27-18-10-12-20(13-11-18)29(25,26)23-16-8-6-15(7-9-16)21(24)22-17-4-3-5-19(14-17)28-2/h3-14,23H,1-2H3,(H,22,24)
InChIKeyKFQLPORQQFQDON-UHFFFAOYSA-N
XLogP3.76
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.47
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 27167578
4-[(4-ethoxyphenyl)sulfamoyl]-N-(3-methoxyphenyl)benzamide
CID 27167584
N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26579550
3-methoxy-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 5156929
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 4213453
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901
4-(methanesulfonamido)-N-(3-methoxyphenyl)benzamide
CID 958689
3-(benzenesulfonamido)-N-(3-methoxyphenyl)benzamide
CID 7541945
3-[(4-methoxyphenyl)sulfonylamino]-N-[4-[4-[[3-[(4-methoxyphenyl)sulfonylamino]benzoyl]amino]phenyl]phenyl]benzamide
CID 121043305
methyl 3-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamoyl]benzoate
CID 17175147
N-(2-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7939173

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
The IUPAC name of N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide (CID 7553556) is N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide is COc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3cccc(OC)c3)cc2)cc1.
What is the InChIKey of N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
The InChIKey is KFQLPORQQFQDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O5S/c1-27-18-10-12-20(13-11-18)29(25,26)23-16-8-6-15(7-9-16)21(24)22-17-4-3-5-19(14-17)28-2/h3-14,23H,1-2H3,(H,22,24).
What are the key properties of N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide has a molecular weight of 412.47 g/mol, XLogP of 3.76, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 7553556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).