3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane

C288H567N37O6S6 — CID 157253524

About 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane

3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane (PubChem CID 157253524) has the molecular formula C288H567N37O6S6 and a molecular weight of 4837.36 g/mol. Its IUPAC name is 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane.

Molecular Properties

• Compound Name: 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane
• PubChem CID: 157253524
• Molecular Formula: C288H567N37O6S6
• Molecular Weight: 4837.36 g/mol
• Exact Mass: 4833.35
• IUPAC Name: 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)C1=CN=CC1C(C)(C)C.CC(C)(C)c1c[nH]cc1C(C)(C)C.CC(C)(C)c1ccnn1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cncn1C(C)(C)C.CC(C)(C)c1cocc1C(C)(C)C.CC(C)(C)c1conc1C(C)(C)C.CC(C)(C)c1conc1C(C)(C)C.CC(C)(C)c1cscc1C(C)(C)C.CC(C)(C)c1csnc1C(C)(C)C.CC(C)(C)c1csnc1C(C)(C)C.CC(C)(C)c1n[nH]nc1C(C)(C)C.CC(C)(C)c1nc[nH]c1C(C)(C)C.CC(C)(C)c1nc[nH]c1C(C)(C)C.CC(C)(C)c1ncoc1C(C)(C)C.CC(C)(C)c1ncoc1C(C)(C)C.CC(C)(C)c1ncsc1C(C)(C)C.CC(C)(C)c1ncsc1C(C)(C)C.CC(C)(C)c1nnnn1C(C)(C)C.CC(C)(C)c1nonc1C(C)(C)C.CC(C)(C)c1nsnc1C(C)(C)C
• InChI: InChI=1S/2C12H21N.C12H20O.C12H20S.8C11H20N2.4C11H19NO.4C11H19NS.C10H19N3.C10H18N2O.C10H18N2S.C9H18N4.25CH4/c4*1-11(2,3)9-7-13-8-10(9)12(4,5)6;2*1-10(2,3)8-9(11(4,5)6)13-7-12-8;1-10(2,3)9-7-12-8-13(9)11(4,5)6;4*1-10(2,3)8-7-12-13-9(8)11(4,5)6;1-10(2,3)9-7-8-12-13(9)11(4,5)6;2*1-10(2,3)8-9(11(4,5)6)13-7-12-8;2*1-10(2,3)8-7-13-12-9(8)11(4,5)6;2*1-10(2,3)8-9(11(4,5)6)13-7-12-8;2*1-10(2,3)8-7-13-12-9(8)11(4,5)6;3*1-9(2,3)7-8(10(4,5)6)12-13-11-7;1-8(2,3)7-10-11-12-13(7)9(4,5)6;;;;;;;;;;;;;;;;;;;;;;;;;/h7-8,13H,1-6H3;7-9H,1-6H3;2*7-8H,1-6H3;2*7H,1-6H3,(H,12,13);7-8H,1-6H3;4*7H,1-6H3,(H,12,13);7-8H,1-6H3;8*7H,1-6H3;1-6H3,(H,11,12,13);3*1-6H3;25*1H4
• InChIKey: AWPNQVWAGFKSGL-UHFFFAOYSA-N
• XLogP: 93.25
• TPSA: 554.56 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 41
• Heavy Atoms: 337
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4837.36
LogP ≤ 5	93.25
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane?

The IUPAC name of 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane (CID 157253524) is 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane.

What is the SMILES notation for 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane?

The canonical SMILES for 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)C1=CN=CC1C(C)(C)C.CC(C)(C)c1c[nH]cc1C(C)(C)C.CC(C)(C)c1ccnn1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cn[nH]c1C(C)(C)C.CC(C)(C)c1cncn1C(C)(C)C.CC(C)(C)c1cocc1C(C)(C)C.CC(C)(C)c1conc1C(C)(C)C.CC(C)(C)c1conc1C(C)(C)C.CC(C)(C)c1cscc1C(C)(C)C.CC(C)(C)c1csnc1C(C)(C)C.CC(C)(C)c1csnc1C(C)(C)C.CC(C)(C)c1n[nH]nc1C(C)(C)C.CC(C)(C)c1nc[nH]c1C(C)(C)C.CC(C)(C)c1nc[nH]c1C(C)(C)C.CC(C)(C)c1ncoc1C(C)(C)C.CC(C)(C)c1ncoc1C(C)(C)C.CC(C)(C)c1ncsc1C(C)(C)C.CC(C)(C)c1ncsc1C(C)(C)C.CC(C)(C)c1nnnn1C(C)(C)C.CC(C)(C)c1nonc1C(C)(C)C.CC(C)(C)c1nsnc1C(C)(C)C.

What is the InChIKey of 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane?

The InChIKey is AWPNQVWAGFKSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H21N.C12H20O.C12H20S.8C11H20N2.4C11H19NO.4C11H19NS.C10H19N3.C10H18N2O.C10H18N2S.C9H18N4.25CH4/c4*1-11(2,3)9-7-13-8-10(9)12(4,5)6;2*1-10(2,3)8-9(11(4,5)6)13-7-12-8;1-10(2,3)9-7-12-8-13(9)11(4,5)6;4*1-10(2,3)8-7-12-13-9(8)11(4,5)6;1-10(2,3)9-7-8-12-13(9)11(4,5)6;2*1-10(2,3)8-9(11(4,5)6)13-7-12-8;2*1-10(2,3)8-7-13-12-9(8)11(4,5)6;2*1-10(2,3)8-9(11(4,5)6)13-7-12-8;2*1-10(2,3)8-7-13-12-9(8)11(4,5)6;3*1-9(2,3)7-8(10(4,5)6)12-13-11-7;1-8(2,3)7-10-11-12-13(7)9(4,5)6;;;;;;;;;;;;;;;;;;;;;;;;;/h7-8,13H,1-6H3;7-9H,1-6H3;2*7-8H,1-6H3;2*7H,1-6H3,(H,12,13);7-8H,1-6H3;4*7H,1-6H3,(H,12,13);7-8H,1-6H3;8*7H,1-6H3;1-6H3,(H,11,12,13);3*1-6H3;25*1H4.

What are the key properties of 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane?

3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane has a molecular weight of 4837.36 g/mol, XLogP of 93.25, 0 rotatable bonds, 8 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 3,4-ditert-butylfuran;1,5-ditert-butylimidazole;bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2,5-oxadiazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);1,5-ditert-butylpyrazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);3,4-ditert-butyl-1H-pyrrole;3,4-ditert-butyl-3H-pyrrole;1,5-ditert-butyltetrazole;3,4-ditert-butyl-1,2,5-thiadiazole;bis(3,4-ditert-butyl-1,2-thiazole);bis(4,5-ditert-butyl-1,3-thiazole);3,4-ditert-butylthiophene;4,5-ditert-butyl-2H-triazole;methane is sourced from PubChem (CID 157253524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).