N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide

C23H24N2O3S — CID 55865615

IUPACN-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3c(C)cccc3C)cc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-4-18-8-10-19(11-9-18)23(26)24-20-12-14-21(15-13-20)29(27,28)25-22-16(2)6-5-7-17(22)3/h5-15,25H,4H2,1-3H3,(H,24,26)
InChIKeyHYHJNDPAYQAPLG-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.92
Rot. Bonds6

About N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide

N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide (PubChem CID 55865615) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide.

Molecular Properties

Compound NameN-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide
PubChem CID55865615
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC NameN-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3c(C)cccc3C)cc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-4-18-8-10-19(11-9-18)23(26)24-20-12-14-21(15-13-20)29(27,28)25-22-16(2)6-5-7-17(22)3/h5-15,25H,4H2,1-3H3,(H,24,26)
InChIKeyHYHJNDPAYQAPLG-UHFFFAOYSA-N
XLogP4.92
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]benzamide
CID 2725735
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-[(4-methylphenyl)sulfanylmethyl]benzamide
CID 126415995
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-3-fluorobenzamide
CID 55865230
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-(2-ethoxyethoxy)benzamide
CID 17112658
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-(morpholin-4-ylsulfonylmethyl)benzamide
CID 43886199
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-[(4-methylpiperidin-1-yl)methyl]benzamide
CID 92671720
4-[benzyl(methylsulfonyl)amino]-N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]benzamide
CID 43880749
N-(2,6-dimethylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 109061714
4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17108469
N-(2-ethyl-6-methylphenyl)-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 112770779
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide
CID 4933955
N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-4-ethylbenzamide
CID 19225858

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide?
The IUPAC name of N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide (CID 55865615) is N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide.
What is the SMILES notation for N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide?
The canonical SMILES for N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide is CCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3c(C)cccc3C)cc2)cc1.
What is the InChIKey of N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide?
The InChIKey is HYHJNDPAYQAPLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-4-18-8-10-19(11-9-18)23(26)24-20-12-14-21(15-13-20)29(27,28)25-22-16(2)6-5-7-17(22)3/h5-15,25H,4H2,1-3H3,(H,24,26).
What are the key properties of N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide?
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide has a molecular weight of 408.52 g/mol, XLogP of 4.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide is sourced from PubChem (CID 55865615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).