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

C24H18N6O3S2 — CID 141303030

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

4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine (PubChem CID 141303030) has the molecular formula C24H18N6O3S2 and a molecular weight of 502.58 g/mol. Its IUPAC name is 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine.

Molecular Properties

• Compound Name: 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine
• PubChem CID: 141303030
• Molecular Formula: C24H18N6O3S2
• Molecular Weight: 502.58 g/mol
• Exact Mass: 502.09
• IUPAC Name: 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine
• SMILES: c1c[nH]c(N2OC(c3ncco3)C(c3ccco3)(c3nccs3)C2(c2ncc[nH]2)c2cccs2)c1
• InChI: InChI=1S/C24H18N6O3S2/c1-6-18(25-7-1)30-24(17-5-3-14-34-17,21-27-8-9-28-21)23(16-4-2-12-31-16,22-29-11-15-35-22)19(33-30)20-26-10-13-32-20/h1-15,19,25H,(H,27,28)
• InChIKey: QMIWEHFTOHPOGV-UHFFFAOYSA-N
• XLogP: 5.26
• TPSA: 109.00 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 9
• Rotatable Bonds: 6
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	502.58
LogP ≤ 5	5.26
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

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

The IUPAC name of 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine (CID 141303030) is 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine.

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

The canonical SMILES for 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine is c1c[nH]c(N2OC(c3ncco3)C(c3ccco3)(c3nccs3)C2(c2ncc[nH]2)c2cccs2)c1.

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

The InChIKey is QMIWEHFTOHPOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N6O3S2/c1-6-18(25-7-1)30-24(17-5-3-14-34-17,21-27-8-9-28-21)23(16-4-2-12-31-16,22-29-11-15-35-22)19(33-30)20-26-10-13-32-20/h1-15,19,25H,(H,27,28).

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

4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine has a molecular weight of 502.58 g/mol, XLogP of 5.26, 6 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(furan-2-yl)-3-(1H-imidazol-2-yl)-5-(1,3-oxazol-2-yl)-2-(1H-pyrrol-2-yl)-4-(1,3-thiazol-2-yl)-3-thiophen-2-yl-1,2-oxazolidine is sourced from PubChem (CID 141303030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).