2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide

C23H20Cl2N2O4S — CID 67481295

IUPAC2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(S(N)(=O)=O)cc2C)cc(C(=O)c2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C23H20Cl2N2O4S/c1-13-5-15(8-16(6-13)23(29)17-10-18(24)12-19(25)11-17)9-22(28)27-21-4-3-20(7-14(21)2)32(26,30)31/h3-8,10-12H,9H2,1-2H3,(H,27,28)(H2,26,30,31)
InChIKeyLILUDAIUXQITLM-UHFFFAOYSA-N
MW491.40 g/mol
LogP4.67
Rot. Bonds6

About 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide

2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide (PubChem CID 67481295) has the molecular formula C23H20Cl2N2O4S and a molecular weight of 491.40 g/mol. Its IUPAC name is 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide
PubChem CID67481295
Molecular FormulaC23H20Cl2N2O4S
Molecular Weight491.40 g/mol
Exact Mass490.05
IUPAC Name2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(S(N)(=O)=O)cc2C)cc(C(=O)c2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C23H20Cl2N2O4S/c1-13-5-15(8-16(6-13)23(29)17-10-18(24)12-19(25)11-17)9-22(28)27-21-4-3-20(7-14(21)2)32(26,30)31/h3-8,10-12H,9H2,1-2H3,(H,27,28)(H2,26,30,31)
InChIKeyLILUDAIUXQITLM-UHFFFAOYSA-N
XLogP4.67
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500491.40
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
2-[3-(3-chloro-5-cyanophenoxy)-5-methoxyphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 67480750
2-[4-chloro-2-(3-chloro-5-isocyanobenzoyl)phenoxy]-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 23596816
2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide
CID 43246558
2-tert-butylsulfanyl-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 61132847
N-(4-chloro-2-methylphenyl)-4-sulfamoylbenzamide
CID 26698295
2-cyclobutyl-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 103164399
2-[3-(3-chloro-5-methylphenoxy)-5-methylphenoxy]-N-(2-chloro-4-sulfamoylphenyl)acetamide
CID 143402513
3-methyl-N-(2-methylpropyl)-4-[[2-(4-sulfamoylphenyl)acetyl]amino]benzamide
CID 56510951
N-(2-methyl-4-sulfamoylphenyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 103208716
2,5-dichloro-N-(2-methyl-4-sulfamoylphenyl)thiophene-3-carboxamide
CID 107965296
2-[3-(3-chloro-5-cyanophenoxy)-4-methylphenyl]-N-(2-chloro-4-sulfamoylphenyl)acetamide
CID 21079637

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide?
The IUPAC name of 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide (CID 67481295) is 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide is Cc1cc(CC(=O)Nc2ccc(S(N)(=O)=O)cc2C)cc(C(=O)c2cc(Cl)cc(Cl)c2)c1.
What is the InChIKey of 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide?
The InChIKey is LILUDAIUXQITLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20Cl2N2O4S/c1-13-5-15(8-16(6-13)23(29)17-10-18(24)12-19(25)11-17)9-22(28)27-21-4-3-20(7-14(21)2)32(26,30)31/h3-8,10-12H,9H2,1-2H3,(H,27,28)(H2,26,30,31).
What are the key properties of 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide?
2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide has a molecular weight of 491.40 g/mol, XLogP of 4.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3,5-dichlorobenzoyl)-5-methylphenyl]-N-(2-methyl-4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 67481295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).