N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide

C23H23ClN2O3S — CID 46101926

IUPACN-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide
SMILESCc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NCc2cccc(Cl)c2)c(C)c1
InChIInChI=1S/C23H23ClN2O3S/c1-15-11-16(2)22(17(3)12-15)30(28,29)26-21-10-5-4-9-20(21)23(27)25-14-18-7-6-8-19(24)13-18/h4-13,26H,14H2,1-3H3,(H,25,27)
InChIKeyXFMZNIDMDIDIQS-UHFFFAOYSA-N
MW442.97 g/mol
LogP5.00
Rot. Bonds6

About N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide

N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide (PubChem CID 46101926) has the molecular formula C23H23ClN2O3S and a molecular weight of 442.97 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide
PubChem CID46101926
Molecular FormulaC23H23ClN2O3S
Molecular Weight442.97 g/mol
Exact Mass442.11
IUPAC NameN-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide
SMILESCc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NCc2cccc(Cl)c2)c(C)c1
InChIInChI=1S/C23H23ClN2O3S/c1-15-11-16(2)22(17(3)12-15)30(28,29)26-21-10-5-4-9-20(21)23(27)25-14-18-7-6-8-19(24)13-18/h4-13,26H,14H2,1-3H3,(H,25,27)
InChIKeyXFMZNIDMDIDIQS-UHFFFAOYSA-N
XLogP5.00
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.97
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3-chlorophenyl)methyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 2333220
2-[[2-[(2,4,6-trimethylphenyl)sulfonylamino]benzoyl]amino]benzoic acid
CID 23378591
N-(3-ethoxypropyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide
CID 17311471
N-[(3-chlorophenyl)methyl]-2-hydroxybenzamide
CID 18105910
N-[(4-methylphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 2979882
N-[(3-chlorophenyl)methyl]-4-[(2-chlorophenyl)sulfamoyl]benzamide
CID 46529076
2-(benzenesulfonamido)-N-benzylbenzamide
CID 1320833
N-(1,3-benzodioxol-5-ylmethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide
CID 2373674
N-(2-phenylethyl)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]benzamide
CID 2336942
N-[(3-chlorophenyl)methyl]-4-fluoro-2-methylbenzamide
CID 113268545
2,3-dichloro-N-[(3-chlorophenyl)methyl]benzamide
CID 17071308
N-[(3-chlorophenyl)methyl]-5-(diethylsulfamoyl)-2-methylbenzamide
CID 9165368

Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide (CID 46101926) is N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide is Cc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NCc2cccc(Cl)c2)c(C)c1.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide?
The InChIKey is XFMZNIDMDIDIQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN2O3S/c1-15-11-16(2)22(17(3)12-15)30(28,29)26-21-10-5-4-9-20(21)23(27)25-14-18-7-6-8-19(24)13-18/h4-13,26H,14H2,1-3H3,(H,25,27).
What are the key properties of N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide?
N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide has a molecular weight of 442.97 g/mol, XLogP of 5.00, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-2-[(2,4,6-trimethylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 46101926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).