2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole

C23H16N10O2S — CID 141266509

About 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole

2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole (PubChem CID 141266509) has the molecular formula C23H16N10O2S and a molecular weight of 496.52 g/mol. Its IUPAC name is 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole.

Molecular Properties

• Compound Name: 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole
• PubChem CID: 141266509
• Molecular Formula: C23H16N10O2S
• Molecular Weight: 496.52 g/mol
• Exact Mass: 496.12
• IUPAC Name: 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole
• SMILES: c1c[nH]c(C2(c3nccs3)C(c3ccn[nH]3)=NC(c3ncco3)=C(c3ccon3)N2c2ncc[nH]2)c1
• InChI: InChI=1S/C23H16N10O2S/c1-2-16(24-5-1)23(21-26-10-13-36-21)19(15-3-6-29-31-15)30-17(20-25-9-12-34-20)18(14-4-11-35-32-14)33(23)22-27-7-8-28-22/h1-13,24H,(H,27,28)(H,29,31)
• InChIKey: ZIEQSXPDRMUCNW-UHFFFAOYSA-N
• XLogP: 3.67
• TPSA: 153.70 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 10
• Rotatable Bonds: 6
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	496.52
LogP ≤ 5	3.67
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole?

The IUPAC name of 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole (CID 141266509) is 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole.

What is the SMILES notation for 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole?

The canonical SMILES for 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole is c1c[nH]c(C2(c3nccs3)C(c3ccn[nH]3)=NC(c3ncco3)=C(c3ccon3)N2c2ncc[nH]2)c1.

What is the InChIKey of 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole?

The InChIKey is ZIEQSXPDRMUCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N10O2S/c1-2-16(24-5-1)23(21-26-10-13-36-21)19(15-3-6-29-31-15)30-17(20-25-9-12-34-20)18(14-4-11-35-32-14)33(23)22-27-7-8-28-22/h1-13,24H,(H,27,28)(H,29,31).

What are the key properties of 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole?

2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole has a molecular weight of 496.52 g/mol, XLogP of 3.67, 6 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(1H-imidazol-2-yl)-3-(1,2-oxazol-3-yl)-6-(1H-pyrazol-5-yl)-5-(1H-pyrrol-2-yl)-5-(1,3-thiazol-2-yl)pyrazin-2-yl]-1,3-oxazole is sourced from PubChem (CID 141266509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).