5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide

C24H20FN3O3S2 — CID 55841538

About 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide

5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide (PubChem CID 55841538) has the molecular formula C24H20FN3O3S2 and a molecular weight of 481.57 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide.

Molecular Properties

• Compound Name: 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide
• PubChem CID: 55841538
• Molecular Formula: C24H20FN3O3S2
• Molecular Weight: 481.57 g/mol
• Exact Mass: 481.09
• IUPAC Name: 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide
• SMILES: Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NCc1nc(-c2ccccc2)cs1
• InChI: InChI=1S/C24H20FN3O3S2/c1-16-11-12-18(33(30,31)28-21-10-6-5-9-20(21)25)13-19(16)24(29)26-14-23-27-22(15-32-23)17-7-3-2-4-8-17/h2-13,15,28H,14H2,1H3,(H,26,29)
• InChIKey: FSYOLPFDSIXCFG-UHFFFAOYSA-N
• XLogP: 4.99
• TPSA: 88.16 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	481.57
LogP ≤ 5	4.99
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide?

The IUPAC name of 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide (CID 55841538) is 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide.

What is the SMILES notation for 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide?

The canonical SMILES for 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide is Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NCc1nc(-c2ccccc2)cs1.

What is the InChIKey of 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide?

The InChIKey is FSYOLPFDSIXCFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN3O3S2/c1-16-11-12-18(33(30,31)28-21-10-6-5-9-20(21)25)13-19(16)24(29)26-14-23-27-22(15-32-23)17-7-3-2-4-8-17/h2-13,15,28H,14H2,1H3,(H,26,29).

What are the key properties of 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide?

5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide has a molecular weight of 481.57 g/mol, XLogP of 4.99, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]benzamide is sourced from PubChem (CID 55841538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).