5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide

C22H19N3O6S2 — CID 19467487

IUPAC5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide
SMILESCOc1ccccc1OCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3nccs3)cc2)o1
InChIInChI=1S/C22H19N3O6S2/c1-29-18-4-2-3-5-19(18)30-14-16-8-11-20(31-16)21(26)24-15-6-9-17(10-7-15)33(27,28)25-22-23-12-13-32-22/h2-13H,14H2,1H3,(H,23,25)(H,24,26)
InChIKeySQVBQUWKJNSTSJ-UHFFFAOYSA-N
MW485.54 g/mol
LogP4.38
Rot. Bonds9

About 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide

5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide (PubChem CID 19467487) has the molecular formula C22H19N3O6S2 and a molecular weight of 485.54 g/mol. Its IUPAC name is 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide
PubChem CID19467487
Molecular FormulaC22H19N3O6S2
Molecular Weight485.54 g/mol
Exact Mass485.07
IUPAC Name5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide
SMILESCOc1ccccc1OCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3nccs3)cc2)o1
InChIInChI=1S/C22H19N3O6S2/c1-29-18-4-2-3-5-19(18)30-14-16-8-11-20(31-16)21(26)24-15-6-9-17(10-7-15)33(27,28)25-22-23-12-13-32-22/h2-13H,14H2,1H3,(H,23,25)(H,24,26)
InChIKeySQVBQUWKJNSTSJ-UHFFFAOYSA-N
XLogP4.38
TPSA119.76 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.54
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

5-[(2-nitrophenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide
CID 19446306
5-[(4-acetylphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide
CID 19455196
5-[(4-chloro-3-methylphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide
CID 19416952
5-(naphthalen-1-yloxymethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]furan-2-carboxamide
CID 19412861
N-(4-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19467513
3-(2-methoxyphenyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]prop-2-enamide
CID 1182198
5-[(2-methoxyphenoxy)methyl]-N-(3,4,5-trimethoxyphenyl)furan-2-carboxamide
CID 3153929
methyl 2-[[2-[4-[[5-[(2-methoxyphenoxy)methyl]furan-2-carbonyl]amino]phenyl]acetyl]amino]acetate
CID 55781590
methyl 4-[[5-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamoyl]furan-2-yl]methoxy]benzoate
CID 19448991
2-(2-ethoxyethoxy)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide
CID 17122725
5-[(2,4-dichlorophenoxy)methyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]furan-2-carboxamide
CID 19456853
4-(2-aminophenoxy)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide
CID 84553695

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide?
The IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide (CID 19467487) is 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide?
The canonical SMILES for 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide is COc1ccccc1OCc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3nccs3)cc2)o1.
What is the InChIKey of 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide?
The InChIKey is SQVBQUWKJNSTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O6S2/c1-29-18-4-2-3-5-19(18)30-14-16-8-11-20(31-16)21(26)24-15-6-9-17(10-7-15)33(27,28)25-22-23-12-13-32-22/h2-13H,14H2,1H3,(H,23,25)(H,24,26).
What are the key properties of 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide?
5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide has a molecular weight of 485.54 g/mol, XLogP of 4.38, 9 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxyphenoxy)methyl]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 19467487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).