3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole

C26H19N9O3S2 — CID 141061474

About 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole

3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole (PubChem CID 141061474) has the molecular formula C26H19N9O3S2 and a molecular weight of 569.63 g/mol. Its IUPAC name is 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole.

Molecular Properties

• Compound Name: 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole
• PubChem CID: 141061474
• Molecular Formula: C26H19N9O3S2
• Molecular Weight: 569.63 g/mol
• Exact Mass: 569.11
• IUPAC Name: 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole
• SMILES: c1c[nH]c(C2(c3ccsn3)C(c3ccco3)(c3cccs3)ON(c3ccn[nH]3)C2(c2cnon2)c2ncc[nH]2)c1
• InChI: InChI=1S/C26H19N9O3S2/c1-4-17(27-9-1)24(18-8-15-40-34-18)25(19-16-31-38-33-19,23-28-11-12-29-23)35(22-7-10-30-32-22)37-26(24,20-5-2-13-36-20)21-6-3-14-39-21/h1-16,27H,(H,28,29)(H,30,32)
• InChIKey: ZPIWXTXHBUQWJQ-UHFFFAOYSA-N
• XLogP: 4.58
• TPSA: 150.57 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 11
• Rotatable Bonds: 7
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	569.63
LogP ≤ 5	4.58
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole?

The IUPAC name of 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole (CID 141061474) is 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole.

What is the SMILES notation for 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole?

The canonical SMILES for 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole is c1c[nH]c(C2(c3ccsn3)C(c3ccco3)(c3cccs3)ON(c3ccn[nH]3)C2(c2cnon2)c2ncc[nH]2)c1.

What is the InChIKey of 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole?

The InChIKey is ZPIWXTXHBUQWJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N9O3S2/c1-4-17(27-9-1)24(18-8-15-40-34-18)25(19-16-31-38-33-19,23-28-11-12-29-23)35(22-7-10-30-32-22)37-26(24,20-5-2-13-36-20)21-6-3-14-39-21/h1-16,27H,(H,28,29)(H,30,32).

What are the key properties of 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole?

3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole has a molecular weight of 569.63 g/mol, XLogP of 4.58, 7 rotatable bonds, 3 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[5-(furan-2-yl)-3-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-4-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-5-thiophen-2-yl-1,2-oxazolidin-3-yl]-1,2,5-oxadiazole is sourced from PubChem (CID 141061474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).