2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide

C18H17N3O4S2 — CID 91630724

IUPAC2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide
SMILESCOc1ccc(S(=O)(=O)NCc2cncc(-c3cccs3)c2)cc1C(N)=O
InChIInChI=1S/C18H17N3O4S2/c1-25-16-5-4-14(8-15(16)18(19)22)27(23,24)21-10-12-7-13(11-20-9-12)17-3-2-6-26-17/h2-9,11,21H,10H2,1H3,(H2,19,22)
InChIKeyAUGMCTSYYDEWDI-UHFFFAOYSA-N
MW403.49 g/mol
LogP2.40
Rot. Bonds7

About 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide

2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide (PubChem CID 91630724) has the molecular formula C18H17N3O4S2 and a molecular weight of 403.49 g/mol. Its IUPAC name is 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide.

Molecular Properties

Compound Name2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide
PubChem CID91630724
Molecular FormulaC18H17N3O4S2
Molecular Weight403.49 g/mol
Exact Mass403.07
IUPAC Name2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide
SMILESCOc1ccc(S(=O)(=O)NCc2cncc(-c3cccs3)c2)cc1C(N)=O
InChIInChI=1S/C18H17N3O4S2/c1-25-16-5-4-14(8-15(16)18(19)22)27(23,24)21-10-12-7-13(11-20-9-12)17-3-2-6-26-17/h2-9,11,21H,10H2,1H3,(H2,19,22)
InChIKeyAUGMCTSYYDEWDI-UHFFFAOYSA-N
XLogP2.40
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.49
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methoxy-5-[(5-thiophen-2-ylfuran-2-yl)methylsulfamoyl]benzamide
CID 122264461
4-(2-methyl-1,3-oxazol-4-yl)-N-[(5-thiophen-2-yl-3-pyridinyl)methyl]benzenesulfonamide
CID 91630721
5-[(2-chlorophenyl)methylsulfamoyl]-2-methoxybenzamide
CID 34029898
5-(furan-2-ylmethylsulfamoyl)-2-methoxybenzamide
CID 34027934
2-fluoro-N-[(5-thiophen-2-yl-3-pyridinyl)methyl]benzenesulfonamide
CID 91630702
5-[[2-(2-hydroxyethoxy)-2-thiophen-2-ylethyl]sulfamoyl]-2-methoxybenzamide
CID 121023366
5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide
CID 65113342
5-[2-(1H-imidazol-5-yl)ethylsulfamoyl]-2-methoxybenzamide
CID 146024582
1-(2-methoxyethyl)-3-[(5-thiophen-2-yl-3-pyridinyl)methyl]urea
CID 91630690
(E)-2-(4-methylphenyl)-N-[(5-thiophen-2-yl-3-pyridinyl)methyl]ethenesulfonamide
CID 117055130
5-(tert-butylsulfamoyl)-2-methoxybenzamide
CID 42562024
N-(pyridin-3-ylmethyl)-4-thiophen-2-ylbenzenesulfonamide
CID 141000174

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide?
The IUPAC name of 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide (CID 91630724) is 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide.
What is the SMILES notation for 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide?
The canonical SMILES for 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide is COc1ccc(S(=O)(=O)NCc2cncc(-c3cccs3)c2)cc1C(N)=O.
What is the InChIKey of 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide?
The InChIKey is AUGMCTSYYDEWDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4S2/c1-25-16-5-4-14(8-15(16)18(19)22)27(23,24)21-10-12-7-13(11-20-9-12)17-3-2-6-26-17/h2-9,11,21H,10H2,1H3,(H2,19,22).
What are the key properties of 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide?
2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide has a molecular weight of 403.49 g/mol, XLogP of 2.40, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(5-thiophen-2-yl-3-pyridinyl)methylsulfamoyl]benzamide is sourced from PubChem (CID 91630724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).