N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide

C19H18N2O4S2 — CID 6504000

IUPACN-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCCNC(=O)c1cc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2)cs1
InChIInChI=1S/C19H18N2O4S2/c1-2-20-19(22)18-12-17(13-26-18)27(23,24)21-14-8-10-16(11-9-14)25-15-6-4-3-5-7-15/h3-13,21H,2H2,1H3,(H,20,22)
InChIKeyJJYVZOVEPPAYSZ-UHFFFAOYSA-N
MW402.50 g/mol
LogP4.09
Rot. Bonds7

About N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide

N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide (PubChem CID 6504000) has the molecular formula C19H18N2O4S2 and a molecular weight of 402.50 g/mol. Its IUPAC name is N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide
PubChem CID6504000
Molecular FormulaC19H18N2O4S2
Molecular Weight402.50 g/mol
Exact Mass402.07
IUPAC NameN-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCCNC(=O)c1cc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2)cs1
InChIInChI=1S/C19H18N2O4S2/c1-2-20-19(22)18-12-17(13-26-18)27(23,24)21-14-8-10-16(11-9-14)25-15-6-4-3-5-7-15/h3-13,21H,2H2,1H3,(H,20,22)
InChIKeyJJYVZOVEPPAYSZ-UHFFFAOYSA-N
XLogP4.09
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(4-methoxyphenyl)sulfamoyl]thiophene-2-carboxamide
CID 6486042
2-[[5-(ethylcarbamoyl)thiophen-3-yl]sulfonylamino]-3-methylbutanoic acid
CID 6503964
N-ethyl-2-[4-(phenylsulfamoyl)phenoxy]acetamide
CID 2223893
4-[(4-hydroxyphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504088
4-[(4-methoxyphenyl)sulfamoyl]-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 6504134
4-[(4-methoxyphenyl)methylsulfamoyl]-N-phenylthiophene-2-carboxamide
CID 6504058
4-(4-benzylpiperazin-1-yl)sulfonyl-N-ethylthiophene-2-carboxamide
CID 6504027
N-[4-(2-methoxyethoxy)phenyl]benzenesulfonamide
CID 39874629
4-[(4-phenoxyphenyl)sulfonylamino]-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 43908583
3,4-dichloro-N-(4-phenoxyphenyl)benzenesulfonamide
CID 21210578
4-[(4-cyanophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 61063606
4-[(4-acetylphenyl)sulfamoyl]thiophene-2-carboxamide
CID 6503881

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
The IUPAC name of N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide (CID 6504000) is N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide.
What is the SMILES notation for N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
The canonical SMILES for N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide is CCNC(=O)c1cc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2)cs1.
What is the InChIKey of N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
The InChIKey is JJYVZOVEPPAYSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4S2/c1-2-20-19(22)18-12-17(13-26-18)27(23,24)21-14-8-10-16(11-9-14)25-15-6-4-3-5-7-15/h3-13,21H,2H2,1H3,(H,20,22).
What are the key properties of N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide?
N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide has a molecular weight of 402.50 g/mol, XLogP of 4.09, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(4-phenoxyphenyl)sulfamoyl]thiophene-2-carboxamide is sourced from PubChem (CID 6504000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).