N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide

C22H22N2O4S — CID 8838647

IUPACN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide
SMILESCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C22H22N2O4S/c1-24(2)29(26,27)17-13-14-21(28-3)20(15-17)23-22(25)19-12-8-7-11-18(19)16-9-5-4-6-10-16/h4-15H,1-3H3,(H,23,25)
InChIKeyRHGDUUGKHHKHMY-UHFFFAOYSA-N
MW410.50 g/mol
LogP3.86
Rot. Bonds6

About N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide

N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide (PubChem CID 8838647) has the molecular formula C22H22N2O4S and a molecular weight of 410.50 g/mol. Its IUPAC name is N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide
PubChem CID8838647
Molecular FormulaC22H22N2O4S
Molecular Weight410.50 g/mol
Exact Mass410.13
IUPAC NameN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide
SMILESCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C22H22N2O4S/c1-24(2)29(26,27)17-13-14-21(28-3)20(15-17)23-22(25)19-12-8-7-11-18(19)16-9-5-4-6-10-16/h4-15H,1-3H3,(H,23,25)
InChIKeyRHGDUUGKHHKHMY-UHFFFAOYSA-N
XLogP3.86
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.50
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide?
The IUPAC name of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide (CID 8838647) is N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide.
What is the SMILES notation for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide?
The canonical SMILES for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide is COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide?
The InChIKey is RHGDUUGKHHKHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4S/c1-24(2)29(26,27)17-13-14-21(28-3)20(15-17)23-22(25)19-12-8-7-11-18(19)16-9-5-4-6-10-16/h4-15H,1-3H3,(H,23,25).
What are the key properties of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide?
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide has a molecular weight of 410.50 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-phenylbenzamide is sourced from PubChem (CID 8838647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).