bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole

C48H72N16O2S4 — CID 157284552

About bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole

bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole (PubChem CID 157284552) has the molecular formula C48H72N16O2S4 and a molecular weight of 1033.48 g/mol. Its IUPAC name is bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole.

Molecular Properties

• Compound Name: bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole
• PubChem CID: 157284552
• Molecular Formula: C48H72N16O2S4
• Molecular Weight: 1033.48 g/mol
• Exact Mass: 1032.49
• IUPAC Name: bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole
• SMILES: Cc1cc(C)[nH]n1.Cc1cc(C)on1.Cc1cc(C)on1.Cc1cnc(C)[nH]1.Cc1cnc(C)[nH]1.Cc1cnc(C)s1.Cc1cnc(C)s1.Cc1csc(C)n1.Cc1n[nH]c(C)n1.Cc1nnc(C)s1
• InChI: InChI=1S/3C5H8N2.2C5H7NO.3C5H7NS.C4H7N3.C4H6N2S/c2*1-4-3-6-5(2)7-4;3*1-4-3-5(2)7-6-4;1-4-3-7-5(2)6-4;2*1-4-3-6-5(2)7-4;1-3-5-4(2)7-6-3;1-3-5-6-4(2)7-3/h3*3H,1-2H3,(H,6,7);5*3H,1-2H3;1-2H3,(H,5,6,7);1-2H3
• InChIKey: BABKAEJXNOIEFR-UHFFFAOYSA-N
• XLogP: 12.52
• TPSA: 244.12 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 18
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1033.48
LogP ≤ 5	12.52
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole?

The IUPAC name of bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole (CID 157284552) is bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole.

What is the SMILES notation for bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole?

The canonical SMILES for bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole is Cc1cc(C)[nH]n1.Cc1cc(C)on1.Cc1cc(C)on1.Cc1cnc(C)[nH]1.Cc1cnc(C)[nH]1.Cc1cnc(C)s1.Cc1cnc(C)s1.Cc1csc(C)n1.Cc1n[nH]c(C)n1.Cc1nnc(C)s1.

What is the InChIKey of bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole?

The InChIKey is BABKAEJXNOIEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H8N2.2C5H7NO.3C5H7NS.C4H7N3.C4H6N2S/c2*1-4-3-6-5(2)7-4;3*1-4-3-5(2)7-6-4;1-4-3-7-5(2)6-4;2*1-4-3-6-5(2)7-4;1-3-5-4(2)7-6-3;1-3-5-6-4(2)7-3/h3*3H,1-2H3,(H,6,7);5*3H,1-2H3;1-2H3,(H,5,6,7);1-2H3.

What are the key properties of bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole?

bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole has a molecular weight of 1033.48 g/mol, XLogP of 12.52, 0 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,5-dimethyl-1H-imidazole);bis(3,5-dimethyl-1,2-oxazole);3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3,4-thiadiazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);3,5-dimethyl-1H-1,2,4-triazole is sourced from PubChem (CID 157284552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).