N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide

C19H18N2O5S — CID 644418

IUPACN-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccc(S(=O)(=O)NCc3ccco3)cc2)c1
InChIInChI=1S/C19H18N2O5S/c1-25-16-5-2-4-14(12-16)19(22)21-15-7-9-18(10-8-15)27(23,24)20-13-17-6-3-11-26-17/h2-12,20H,13H2,1H3,(H,21,22)
InChIKeyFLFYVBXKRSIKSU-UHFFFAOYSA-N
MW386.43 g/mol
LogP3.02
Rot. Bonds7

About N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide

N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide (PubChem CID 644418) has the molecular formula C19H18N2O5S and a molecular weight of 386.43 g/mol. Its IUPAC name is N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide
PubChem CID644418
Molecular FormulaC19H18N2O5S
Molecular Weight386.43 g/mol
Exact Mass386.09
IUPAC NameN-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccc(S(=O)(=O)NCc3ccco3)cc2)c1
InChIInChI=1S/C19H18N2O5S/c1-25-16-5-2-4-14(12-16)19(22)21-15-7-9-18(10-8-15)27(23,24)20-13-17-6-3-11-26-17/h2-12,20H,13H2,1H3,(H,21,22)
InChIKeyFLFYVBXKRSIKSU-UHFFFAOYSA-N
XLogP3.02
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-Furan-2-ylmethyl-4-[4-(4-methoxy-phenyl)-piperazine-1-sulfonyl]-benzamide
CID 652023
N-[2-methoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 2987883
4-{[(3-fluorophenyl)sulfonyl]amino}-N-(2-furylmethyl)benzamide
CID 984669
N-(furan-2-ylmethyl)-3-[phenyl(prop-2-enyl)sulfamoyl]benzamide
CID 2704666
4-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide
CID 3314293
Anti-Influenza agent 4
CID 4156245
(1-Anilino-1-oxopropan-2-yl) 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 4791564
3-chloro-N-[3-(furan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 5206502
3-[(furan-2-ylmethyl)sulfamoyl]-N-phenylbenzamide
CID 1368140
3-[(4-Phenyl-1-piperazinyl)sulfonyl]benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester
CID 2999387
4-fluoro-3-(furan-2-ylmethylsulfamoyl)-N-(3-methylphenyl)benzamide
CID 3435304
N-(2-furylmethyl)-N-methyl-N-[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]phenylalaninamide
CID 5308286

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide?
The IUPAC name of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide (CID 644418) is N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide.
What is the SMILES notation for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide?
The canonical SMILES for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide is COc1cccc(C(=O)Nc2ccc(S(=O)(=O)NCc3ccco3)cc2)c1.
What is the InChIKey of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide?
The InChIKey is FLFYVBXKRSIKSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O5S/c1-25-16-5-2-4-14(12-16)19(22)21-15-7-9-18(10-8-15)27(23,24)20-13-17-6-3-11-26-17/h2-12,20H,13H2,1H3,(H,21,22).
What are the key properties of N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide?
N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide has a molecular weight of 386.43 g/mol, XLogP of 3.02, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methoxybenzamide is sourced from PubChem (CID 644418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).