5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide

C17H17ClN4O5S — CID 53183028

IUPAC5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(-c3[nH]ncc3C(=O)N(C)C)o2)cc1Cl
InChIInChI=1S/C17H17ClN4O5S/c1-22(2)17(23)11-9-19-20-16(11)14-6-7-15(27-14)28(24,25)21-10-4-5-13(26-3)12(18)8-10/h4-9,21H,1-3H3,(H,19,20)
InChIKeyIQYIQRLWXZFSCG-UHFFFAOYSA-N
MW424.87 g/mol
LogP2.83
Rot. Bonds6

About 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide

5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide (PubChem CID 53183028) has the molecular formula C17H17ClN4O5S and a molecular weight of 424.87 g/mol. Its IUPAC name is 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide
PubChem CID53183028
Molecular FormulaC17H17ClN4O5S
Molecular Weight424.87 g/mol
Exact Mass424.06
IUPAC Name5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(-c3[nH]ncc3C(=O)N(C)C)o2)cc1Cl
InChIInChI=1S/C17H17ClN4O5S/c1-22(2)17(23)11-9-19-20-16(11)14-6-7-15(27-14)28(24,25)21-10-4-5-13(26-3)12(18)8-10/h4-9,21H,1-3H3,(H,19,20)
InChIKeyIQYIQRLWXZFSCG-UHFFFAOYSA-N
XLogP2.83
TPSA117.53 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.87
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide with MolForge

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Related Compounds

5-[4-[(3-chloro-4-methoxyphenyl)sulfamoyl]-5-methylfuran-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide
CID 53183202
5-(aminomethyl)-N-(3-chloro-4-methoxyphenyl)furan-2-sulfonamide
CID 106048091
methyl 2-[(3-chloro-4-methoxyphenyl)sulfamoyl]benzoate
CID 8523413
4-chloro-N-(3-chloro-4-methoxyphenyl)benzenesulfonamide
CID 808097
methyl 4-[(3-chloro-4-methoxyphenyl)sulfamoyl]benzoate
CID 26487204
N-(3-chloro-4-methoxyphenyl)-4-hydrazinylbenzenesulfonamide
CID 43454822
3-chloro-4-methoxy-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 112691520
4-[(4-acetamidophenyl)sulfonylamino]-2-chloro-N,N-dimethylbenzamide
CID 110314496
N-(3-chloro-4-methoxyphenyl)pyridine-3-sulfonamide
CID 110865835
3-[(3-chloro-4-methoxyphenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 43235749
N-(3-chloro-4-methoxyphenyl)-4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonamide
CID 22583132
2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide
CID 2242342

Frequently Asked Questions

What is the IUPAC name of 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide (CID 53183028) is 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide is COc1ccc(NS(=O)(=O)c2ccc(-c3[nH]ncc3C(=O)N(C)C)o2)cc1Cl.
What is the InChIKey of 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide?
The InChIKey is IQYIQRLWXZFSCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN4O5S/c1-22(2)17(23)11-9-19-20-16(11)14-6-7-15(27-14)28(24,25)21-10-4-5-13(26-3)12(18)8-10/h4-9,21H,1-3H3,(H,19,20).
What are the key properties of 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide?
5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide has a molecular weight of 424.87 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[(3-chloro-4-methoxyphenyl)sulfamoyl]furan-2-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 53183028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).