N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide

C19H20N4O4S2 — CID 166752364

About N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide

N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 166752364) has the molecular formula C19H20N4O4S2 and a molecular weight of 432.53 g/mol. Its IUPAC name is N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

• Compound Name: N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide
• PubChem CID: 166752364
• Molecular Formula: C19H20N4O4S2
• Molecular Weight: 432.53 g/mol
• Exact Mass: 432.09
• IUPAC Name: N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide
• SMILES: COc1ncc(NC(=O)c2scnc2C)cc1S(=O)(=O)Nc1c(C)cccc1C
• InChI: InChI=1S/C19H20N4O4S2/c1-11-6-5-7-12(2)16(11)23-29(25,26)15-8-14(9-20-19(15)27-4)22-18(24)17-13(3)21-10-28-17/h5-10,23H,1-4H3,(H,22,24)
• InChIKey: WXLOUJNOWKYAML-UHFFFAOYSA-N
• XLogP: 3.53
• TPSA: 110.28 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	432.53
LogP ≤ 5	3.53
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide?

The IUPAC name of N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide (CID 166752364) is N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide.

What is the SMILES notation for N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide?

The canonical SMILES for N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide is COc1ncc(NC(=O)c2scnc2C)cc1S(=O)(=O)Nc1c(C)cccc1C.

What is the InChIKey of N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide?

The InChIKey is WXLOUJNOWKYAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4S2/c1-11-6-5-7-12(2)16(11)23-29(25,26)15-8-14(9-20-19(15)27-4)22-18(24)17-13(3)21-10-28-17/h5-10,23H,1-4H3,(H,22,24).

What are the key properties of N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide?

N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 432.53 g/mol, XLogP of 3.53, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[(2,6-dimethylphenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 166752364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).