4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide

C22H19N3O4S — CID 55567977

IUPAC4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide
SMILESO=C(Nc1cccc(-n2cccc2)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C22H19N3O4S/c26-22(24-18-5-3-6-19(15-18)25-12-1-2-13-25)17-8-10-21(11-9-17)30(27,28)23-16-20-7-4-14-29-20/h1-15,23H,16H2,(H,24,26)
InChIKeySFHOEEHIUANYBA-UHFFFAOYSA-N
MW421.48 g/mol
LogP3.80
Rot. Bonds7

About 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide

4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide (PubChem CID 55567977) has the molecular formula C22H19N3O4S and a molecular weight of 421.48 g/mol. Its IUPAC name is 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide.

Molecular Properties

Compound Name4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide
PubChem CID55567977
Molecular FormulaC22H19N3O4S
Molecular Weight421.48 g/mol
Exact Mass421.11
IUPAC Name4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide
SMILESO=C(Nc1cccc(-n2cccc2)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C22H19N3O4S/c26-22(24-18-5-3-6-19(15-18)25-12-1-2-13-25)17-8-10-21(11-9-17)30(27,28)23-16-20-7-4-14-29-20/h1-15,23H,16H2,(H,24,26)
InChIKeySFHOEEHIUANYBA-UHFFFAOYSA-N
XLogP3.80
TPSA93.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.48
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide
CID 55728535
4-(furan-2-ylmethylsulfamoyl)-N-[3-(2-methylpropanoylamino)phenyl]benzamide
CID 55617154
N-(3,4-difluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 9165761
N-[3-(cyclopropylsulfamoyl)phenyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 24584102
N-(4-chlorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 2687824
N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-4-(trifluoromethyl)benzamide
CID 24639746
N-(2,3-dihydro-1H-inden-5-yl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 26864849
3-bromo-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-4-methylbenzamide
CID 17170937
N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 5147041
N-(3-chloro-2-fluorophenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 9146107
4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 98392756
N-(3,5-dimethylphenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
CID 26696313

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide?
The IUPAC name of 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide (CID 55567977) is 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide.
What is the SMILES notation for 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide?
The canonical SMILES for 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide is O=C(Nc1cccc(-n2cccc2)c1)c1ccc(S(=O)(=O)NCc2ccco2)cc1.
What is the InChIKey of 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide?
The InChIKey is SFHOEEHIUANYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O4S/c26-22(24-18-5-3-6-19(15-18)25-12-1-2-13-25)17-8-10-21(11-9-17)30(27,28)23-16-20-7-4-14-29-20/h1-15,23H,16H2,(H,24,26).
What are the key properties of 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide?
4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide has a molecular weight of 421.48 g/mol, XLogP of 3.80, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-ylmethylsulfamoyl)-N-(3-pyrrol-1-ylphenyl)benzamide is sourced from PubChem (CID 55567977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).