N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide

C24H25NO5S — CID 19211422

IUPACN-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide
SMILESCCc1ccc(N(C(=O)c2cc(OC)cc(OC)c2)S(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H25NO5S/c1-5-18-8-10-20(11-9-18)25(31(27,28)23-12-6-17(2)7-13-23)24(26)19-14-21(29-3)16-22(15-19)30-4/h6-16H,5H2,1-4H3
InChIKeyDPYNRJCSPIXZHT-UHFFFAOYSA-N
MW439.53 g/mol
LogP4.61
Rot. Bonds7

About N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide

N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide (PubChem CID 19211422) has the molecular formula C24H25NO5S and a molecular weight of 439.53 g/mol. Its IUPAC name is N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide
PubChem CID19211422
Molecular FormulaC24H25NO5S
Molecular Weight439.53 g/mol
Exact Mass439.15
IUPAC NameN-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide
SMILESCCc1ccc(N(C(=O)c2cc(OC)cc(OC)c2)S(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H25NO5S/c1-5-18-8-10-20(11-9-18)25(31(27,28)23-12-6-17(2)7-13-23)24(26)19-14-21(29-3)16-22(15-19)30-4/h6-16H,5H2,1-4H3
InChIKeyDPYNRJCSPIXZHT-UHFFFAOYSA-N
XLogP4.61
TPSA72.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.53
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethylphenyl)-2-methoxy-N-(4-methylphenyl)sulfonylbenzamide
CID 19210849
N-(benzenesulfonyl)-N-(4-ethylphenyl)-3,4,5-trimethoxybenzamide
CID 19210874
N-(4-butylphenyl)-N-(4-methylphenyl)sulfonylbenzamide
CID 19210617
N-(4-ethylphenyl)-N-(4-methylphenyl)sulfonyl-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 19218327
N-(benzenesulfonyl)-N-(4-ethylphenyl)-2-(4-methylphenoxy)acetamide
CID 19212677
N-(4-ethoxyphenyl)-2-(3-methoxyphenoxy)-N-(4-methylphenyl)sulfonylacetamide
CID 19220163
N-(4-chlorophenyl)sulfonyl-3-methoxy-N-(4-methoxyphenyl)benzamide
CID 19211456
4-tert-butyl-N-(4-ethoxyphenyl)-N-(4-methylphenyl)sulfonylbenzamide
CID 19211038
N-(4-ethoxyphenyl)-N-(4-methylphenyl)sulfonyl-4-phenylbenzamide
CID 19211132
N-(benzenesulfonyl)-N-(4-ethylphenyl)-4-methyl-3-nitrobenzamide
CID 19211337
2-methoxy-N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylbenzamide
CID 1322535
N-(4-methoxyphenyl)-3,3-dimethyl-N-(4-methylphenyl)sulfonylbutanamide
CID 19219311

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide?
The IUPAC name of N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide (CID 19211422) is N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide.
What is the SMILES notation for N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide?
The canonical SMILES for N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide is CCc1ccc(N(C(=O)c2cc(OC)cc(OC)c2)S(=O)(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide?
The InChIKey is DPYNRJCSPIXZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO5S/c1-5-18-8-10-20(11-9-18)25(31(27,28)23-12-6-17(2)7-13-23)24(26)19-14-21(29-3)16-22(15-19)30-4/h6-16H,5H2,1-4H3.
What are the key properties of N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide?
N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide has a molecular weight of 439.53 g/mol, XLogP of 4.61, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-3,5-dimethoxy-N-(4-methylphenyl)sulfonylbenzamide is sourced from PubChem (CID 19211422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).