N-(4-ethoxyphenyl)sulfonylbenzamide

C15H15NO4S — CID 972596

IUPACN-(4-ethoxyphenyl)sulfonylbenzamide
SMILESCCOc1ccc(S(=O)(=O)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C15H15NO4S/c1-2-20-13-8-10-14(11-9-13)21(18,19)16-15(17)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,16,17)
InChIKeyJZUWMRHTBHLOON-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.20
Rot. Bonds5

About N-(4-ethoxyphenyl)sulfonylbenzamide

N-(4-ethoxyphenyl)sulfonylbenzamide (PubChem CID 972596) has the molecular formula C15H15NO4S and a molecular weight of 305.36 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)sulfonylbenzamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)sulfonylbenzamide
PubChem CID972596
Molecular FormulaC15H15NO4S
Molecular Weight305.36 g/mol
Exact Mass305.07
IUPAC NameN-(4-ethoxyphenyl)sulfonylbenzamide
SMILESCCOc1ccc(S(=O)(=O)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C15H15NO4S/c1-2-20-13-8-10-14(11-9-13)21(18,19)16-15(17)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,16,17)
InChIKeyJZUWMRHTBHLOON-UHFFFAOYSA-N
XLogP2.20
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methoxy-5-sulfamoylbenzamide
CID 827160
N-Hydroxy-2-(4-phenoxy-benzenesulfonyl)benzamide
CID 10155934
5-(Benzylsulfamoyl)-2-ethoxybenzamide
CID 1508458
4-(dimethylsulfamoyl)-N-(2-phenoxyethyl)benzamide
CID 2291802
N'-phenylsulfonyl-4-methoxybenzohydrazide
CID 795528
4-({[(4-Methoxyphenyl)sulfonyl]amino}methyl)benzoic acid
CID 3244452
2,4-dichloro-N-(4-methoxyphenyl)sulfonylbenzamide
CID 11164265
4-((N-benzyl-4-ethoxyphenylsulfonamido)methyl)-N-(cyclopropylmethyl)benzamide
CID 44253448
N'-(benzenesulfonyl)-3-propoxybenzohydrazide
CID 124132112
N'-(benzenesulfonyl)-2-fluoro-5-propan-2-yloxybenzohydrazide
CID 124132116
N'-(benzenesulfonyl)-2-fluoro-5-prop-2-enoxybenzohydrazide
CID 124132119
3-ethoxy-5-fluoro-N'-(2-fluorophenyl)sulfonylbenzohydrazide
CID 124132125

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)sulfonylbenzamide?
The IUPAC name of N-(4-ethoxyphenyl)sulfonylbenzamide (CID 972596) is N-(4-ethoxyphenyl)sulfonylbenzamide.
What is the SMILES notation for N-(4-ethoxyphenyl)sulfonylbenzamide?
The canonical SMILES for N-(4-ethoxyphenyl)sulfonylbenzamide is CCOc1ccc(S(=O)(=O)NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)sulfonylbenzamide?
The InChIKey is JZUWMRHTBHLOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4S/c1-2-20-13-8-10-14(11-9-13)21(18,19)16-15(17)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,16,17).
What are the key properties of N-(4-ethoxyphenyl)sulfonylbenzamide?
N-(4-ethoxyphenyl)sulfonylbenzamide has a molecular weight of 305.36 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)sulfonylbenzamide is sourced from PubChem (CID 972596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).