4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide

C24H20N4O5S — CID 55825890

IUPAC4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3ccc(Oc4ncccn4)cc3)cc2)cc1
InChIInChI=1S/C24H20N4O5S/c1-32-20-9-7-19(8-10-20)28-34(30,31)22-13-3-17(4-14-22)23(29)27-18-5-11-21(12-6-18)33-24-25-15-2-16-26-24/h2-16,28H,1H3,(H,27,29)
InChIKeyHAVXOLHQQXWJQG-UHFFFAOYSA-N
MW476.51 g/mol
LogP4.33
Rot. Bonds8

About 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide

4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide (PubChem CID 55825890) has the molecular formula C24H20N4O5S and a molecular weight of 476.51 g/mol. Its IUPAC name is 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide
PubChem CID55825890
Molecular FormulaC24H20N4O5S
Molecular Weight476.51 g/mol
Exact Mass476.12
IUPAC Name4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3ccc(Oc4ncccn4)cc3)cc2)cc1
InChIInChI=1S/C24H20N4O5S/c1-32-20-9-7-19(8-10-20)28-34(30,31)22-13-3-17(4-14-22)23(29)27-18-5-11-21(12-6-18)33-24-25-15-2-16-26-24/h2-16,28H,1H3,(H,27,29)
InChIKeyHAVXOLHQQXWJQG-UHFFFAOYSA-N
XLogP4.33
TPSA119.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.51
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7553556
4-(benzenesulfonamido)-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]benzamide
CID 126415575
4-(2-ethoxyethoxy)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 17112535
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232
4-(diethylsulfamoyl)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 17308419
N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26579550
4-[(4-ethoxyphenyl)sulfamoyl]-N-(3-methoxyphenyl)benzamide
CID 27167584
N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 25400706
N-(2-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7939173
methyl 3-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamoyl]benzoate
CID 17175147
N-(3-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 27167578

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide?
The IUPAC name of 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide (CID 55825890) is 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide.
What is the SMILES notation for 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide?
The canonical SMILES for 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide is COc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3ccc(Oc4ncccn4)cc3)cc2)cc1.
What is the InChIKey of 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide?
The InChIKey is HAVXOLHQQXWJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O5S/c1-32-20-9-7-19(8-10-20)28-34(30,31)22-13-3-17(4-14-22)23(29)27-18-5-11-21(12-6-18)33-24-25-15-2-16-26-24/h2-16,28H,1H3,(H,27,29).
What are the key properties of 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide?
4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide has a molecular weight of 476.51 g/mol, XLogP of 4.33, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenyl)sulfamoyl]-N-(4-pyrimidin-2-yloxyphenyl)benzamide is sourced from PubChem (CID 55825890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).