4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine

C27H19N9O2S3 — CID 141075067

About 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine

4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine (PubChem CID 141075067) has the molecular formula C27H19N9O2S3 and a molecular weight of 597.71 g/mol. Its IUPAC name is 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine.

Molecular Properties

• Compound Name: 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine
• PubChem CID: 141075067
• Molecular Formula: C27H19N9O2S3
• Molecular Weight: 597.71 g/mol
• Exact Mass: 597.08
• IUPAC Name: 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine
• SMILES: c1ccc(C2(c3ccsn3)ON(c3nccs3)C(c3ncc[nH]3)(c3cccs3)C2(c2cn[nH]n2)c2ccco2)nc1
• InChI: InChI=1S/C27H19N9O2S3/c1-2-9-28-18(5-1)27(19-8-15-41-34-19)25(20-17-32-35-33-20,21-6-3-13-37-21)26(22-7-4-14-39-22,23-29-10-11-30-23)36(38-27)24-31-12-16-40-24/h1-17H,(H,29,30)(H,32,33,35)
• InChIKey: JGRUJXDGJCPZHN-UHFFFAOYSA-N
• XLogP: 5.12
• TPSA: 134.53 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 12
• Rotatable Bonds: 7
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	597.71
LogP ≤ 5	5.12
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine?

The IUPAC name of 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine (CID 141075067) is 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine.

What is the SMILES notation for 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine?

The canonical SMILES for 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine is c1ccc(C2(c3ccsn3)ON(c3nccs3)C(c3ncc[nH]3)(c3cccs3)C2(c2cn[nH]n2)c2ccco2)nc1.

What is the InChIKey of 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine?

The InChIKey is JGRUJXDGJCPZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H19N9O2S3/c1-2-9-28-18(5-1)27(19-8-15-41-34-19)25(20-17-32-35-33-20,21-6-3-13-37-21)26(22-7-4-14-39-22,23-29-10-11-30-23)36(38-27)24-31-12-16-40-24/h1-17H,(H,29,30)(H,32,33,35).

What are the key properties of 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine?

4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine has a molecular weight of 597.71 g/mol, XLogP of 5.12, 7 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-pyridin-2-yl-5-(1,2-thiazol-3-yl)-2-(1,3-thiazol-2-yl)-3-thiophen-2-yl-4-(2H-triazol-4-yl)-1,2-oxazolidine is sourced from PubChem (CID 141075067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).