2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)

C69H66N12O12S6 — CID 167706906

About 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)

2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide) (PubChem CID 167706906) has the molecular formula C69H66N12O12S6 and a molecular weight of 1447.76 g/mol. Its IUPAC name is 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide).

Molecular Properties

• Compound Name: 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)
• PubChem CID: 167706906
• Molecular Formula: C69H66N12O12S6
• Molecular Weight: 1447.76 g/mol
• Exact Mass: 1446.32
• IUPAC Name: 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)
• SMILES: Cc1ccc(C(=O)Nc2ncc(C)s2)c(O)c1.Cc1ccc(O)c(C(=O)Nc2ncc(C)s2)c1.Cc1cnc(NC(=O)c2cccc(C)c2O)s1.Cc1cnc(NC(=O)c2ccccc2O)s1.Cc1cnc(NC(=O)c2ccccc2O)s1.Cc1cnc(NC(=O)c2ccccc2O)s1
• InChI: InChI=1S/3C12H12N2O2S.3C11H10N2O2S/c1-7-3-4-10(15)9(5-7)11(16)14-12-13-6-8(2)17-12;1-7-3-4-9(10(15)5-7)11(16)14-12-13-6-8(2)17-12;1-7-4-3-5-9(10(7)15)11(16)14-12-13-6-8(2)17-12;3*1-7-6-12-11(16-7)13-10(15)8-4-2-3-5-9(8)14/h3*3-6,15H,1-2H3,(H,13,14,16);3*2-6,14H,1H3,(H,12,13,15)
• InChIKey: ZFOMWVUZCDQJLB-UHFFFAOYSA-N
• XLogP: 15.38
• TPSA: 373.32 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 24
• Rotatable Bonds: 12
• Heavy Atoms: 99
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1447.76
LogP ≤ 5	15.38
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)?

The IUPAC name of 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide) (CID 167706906) is 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide).

What is the SMILES notation for 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)?

The canonical SMILES for 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide) is Cc1ccc(C(=O)Nc2ncc(C)s2)c(O)c1.Cc1ccc(O)c(C(=O)Nc2ncc(C)s2)c1.Cc1cnc(NC(=O)c2cccc(C)c2O)s1.Cc1cnc(NC(=O)c2ccccc2O)s1.Cc1cnc(NC(=O)c2ccccc2O)s1.Cc1cnc(NC(=O)c2ccccc2O)s1.

What is the InChIKey of 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)?

The InChIKey is ZFOMWVUZCDQJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H12N2O2S.3C11H10N2O2S/c1-7-3-4-10(15)9(5-7)11(16)14-12-13-6-8(2)17-12;1-7-3-4-9(10(15)5-7)11(16)14-12-13-6-8(2)17-12;1-7-4-3-5-9(10(7)15)11(16)14-12-13-6-8(2)17-12;3*1-7-6-12-11(16-7)13-10(15)8-4-2-3-5-9(8)14/h3*3-6,15H,1-2H3,(H,13,14,16);3*2-6,14H,1H3,(H,12,13,15).

What are the key properties of 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)?

2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide) has a molecular weight of 1447.76 g/mol, XLogP of 15.38, 12 rotatable bonds, 12 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide) is sourced from PubChem (CID 167706906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).