3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide

C22H23N3O4S — CID 24538441

IUPAC3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide
SMILESCCc1ccc(NS(=O)(=O)c2cc(C(=O)NCc3ccncc3)ccc2OC)cc1
InChIInChI=1S/C22H23N3O4S/c1-3-16-4-7-19(8-5-16)25-30(27,28)21-14-18(6-9-20(21)29-2)22(26)24-15-17-10-12-23-13-11-17/h4-14,25H,3,15H2,1-2H3,(H,24,26)
InChIKeyGZJRGXBPTYZGGA-UHFFFAOYSA-N
MW425.51 g/mol
LogP3.38
Rot. Bonds8

About 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide

3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide (PubChem CID 24538441) has the molecular formula C22H23N3O4S and a molecular weight of 425.51 g/mol. Its IUPAC name is 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide
PubChem CID24538441
Molecular FormulaC22H23N3O4S
Molecular Weight425.51 g/mol
Exact Mass425.14
IUPAC Name3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide
SMILESCCc1ccc(NS(=O)(=O)c2cc(C(=O)NCc3ccncc3)ccc2OC)cc1
InChIInChI=1S/C22H23N3O4S/c1-3-16-4-7-19(8-5-16)25-30(27,28)21-14-18(6-9-20(21)29-2)22(26)24-15-17-10-12-23-13-11-17/h4-14,25H,3,15H2,1-2H3,(H,24,26)
InChIKeyGZJRGXBPTYZGGA-UHFFFAOYSA-N
XLogP3.38
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.51
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-[(dimethylamino)methyl]phenyl]methyl]-4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 17481816
N-[(4-cyanophenyl)methyl]-4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 46673405
3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methylphenyl)benzamide
CID 26537931
3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 17489130
N-[2-[[3-[(4-ethylphenyl)sulfamoyl]-4-methoxybenzoyl]amino]ethyl]furan-2-carboxamide
CID 24660944
N-[1-(ethylamino)-1-oxopropan-2-yl]-3-[(4-ethylphenyl)sulfamoyl]-4-methoxybenzamide
CID 24595720
N-[2-(dimethylamino)-2-phenylethyl]-3-[(4-ethylphenyl)sulfamoyl]-4-methoxybenzamide
CID 24536279
N-[[6-(diethylamino)-3-pyridinyl]methyl]-4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 55728596
3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 37244496
N-[(4-methoxyphenyl)methyl]-3-[(4-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 2634660
4-methoxy-3-[(4-methylphenyl)sulfamoyl]-N-(pyridin-2-ylmethyl)benzamide
CID 9414541
3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide
CID 43045932

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide?
The IUPAC name of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide (CID 24538441) is 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide.
What is the SMILES notation for 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide?
The canonical SMILES for 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide is CCc1ccc(NS(=O)(=O)c2cc(C(=O)NCc3ccncc3)ccc2OC)cc1.
What is the InChIKey of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide?
The InChIKey is GZJRGXBPTYZGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4S/c1-3-16-4-7-19(8-5-16)25-30(27,28)21-14-18(6-9-20(21)29-2)22(26)24-15-17-10-12-23-13-11-17/h4-14,25H,3,15H2,1-2H3,(H,24,26).
What are the key properties of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide?
3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide has a molecular weight of 425.51 g/mol, XLogP of 3.38, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide is sourced from PubChem (CID 24538441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).