3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide

C21H19ClN2O3S — CID 132664714

IUPAC3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
SMILESCC(NC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1)c1ccccc1
InChIInChI=1S/C21H19ClN2O3S/c1-15(16-6-3-2-4-7-16)23-21(25)17-8-5-9-19(14-17)24-28(26,27)20-12-10-18(22)11-13-20/h2-15,24H,1H3,(H,23,25)
InChIKeyUAIMOOSORGFLEP-UHFFFAOYSA-N
MW414.91 g/mol
LogP4.63
Rot. Bonds6

About 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide

3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide (PubChem CID 132664714) has the molecular formula C21H19ClN2O3S and a molecular weight of 414.91 g/mol. Its IUPAC name is 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
PubChem CID132664714
Molecular FormulaC21H19ClN2O3S
Molecular Weight414.91 g/mol
Exact Mass414.08
IUPAC Name3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
SMILESCC(NC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1)c1ccccc1
InChIInChI=1S/C21H19ClN2O3S/c1-15(16-6-3-2-4-7-16)23-21(25)17-8-5-9-19(14-17)24-28(26,27)20-12-10-18(22)11-13-20/h2-15,24H,1H3,(H,23,25)
InChIKeyUAIMOOSORGFLEP-UHFFFAOYSA-N
XLogP4.63
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.91
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-methylphenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
CID 19062382
3-[(2,5-dichlorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 2079648
2-chloro-4-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
CID 132674716
3-(benzenesulfonamido)-N-[(1S)-1-(4-fluorophenyl)ethyl]benzamide
CID 9409977
3-(benzenesulfonamido)-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide
CID 55657574
3-[(4-chlorophenyl)sulfonylamino]benzoic acid
CID 773554
3-(benzenesulfonamido)-N-[1-(3,4-dimethoxyphenyl)ethyl]benzamide
CID 132611720
N-[(R)-(4-methylphenyl)-phenylmethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 28576591
3-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43877795
N-[3-[(4-chlorophenyl)sulfonylamino]phenyl]benzamide
CID 1216913
3-[(3,4-dichlorophenyl)sulfonylamino]-N-propan-2-ylbenzamide
CID 27648381
N-[1-(4-methoxyphenyl)ethyl]-3-(phenylsulfamoyl)benzamide
CID 132663597

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide?
The IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide (CID 132664714) is 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide?
The canonical SMILES for 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide is CC(NC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1)c1ccccc1.
What is the InChIKey of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide?
The InChIKey is UAIMOOSORGFLEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O3S/c1-15(16-6-3-2-4-7-16)23-21(25)17-8-5-9-19(14-17)24-28(26,27)20-12-10-18(22)11-13-20/h2-15,24H,1H3,(H,23,25).
What are the key properties of 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide?
3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide has a molecular weight of 414.91 g/mol, XLogP of 4.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorophenyl)sulfonylamino]-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 132664714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).