5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine

C73H81N15O10S5 — CID 160793567

About 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine

5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine (PubChem CID 160793567) has the molecular formula C73H81N15O10S5 and a molecular weight of 1488.88 g/mol. Its IUPAC name is 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine.

Molecular Properties

• Compound Name: 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine
• PubChem CID: 160793567
• Molecular Formula: C73H81N15O10S5
• Molecular Weight: 1488.88 g/mol
• Exact Mass: 1487.49
• IUPAC Name: 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine
• SMILES: Cc1ncc(-c2ccc(S(=O)(=O)C3CCCNC3)cc2)nc1-c1cc(-c2ccsc2)no1.Cc1ncc(-c2ccc(S(=O)(=O)C3CCCNC3)cc2)nc1-c1cc(-c2nccs2)no1.Nc1ncc(-c2ccc(S(=O)(=O)C3CCCNC3)cc2)nc1-c1cc(-c2ccc(C3COCCN3)cc2)no1.[H][H].[H][H].[H][H].[H][H]
• InChI: InChI=1S/C28H30N6O4S.C23H22N4O3S2.C22H21N5O3S2.4H2/c29-28-27(26-14-23(34-38-26)18-3-5-20(6-4-18)25-17-37-13-12-31-25)33-24(16-32-28)19-7-9-21(10-8-19)39(35,36)22-2-1-11-30-15-22;1-15-23(22-11-20(27-30-22)17-8-10-31-14-17)26-21(13-25-15)16-4-6-18(7-5-16)32(28,29)19-3-2-9-24-12-19;1-14-21(20-11-18(27-30-20)22-24-9-10-31-22)26-19(13-25-14)15-4-6-16(7-5-15)32(28,29)17-3-2-8-23-12-17;;;;/h3-10,14,16,22,25,30-31H,1-2,11-13,15,17H2,(H2,29,32);4-8,10-11,13-14,19,24H,2-3,9,12H2,1H3;4-7,9-11,13,17,23H,2-3,8,12H2,1H3;4*1H
• InChIKey: SCDIVQUZBLZDAG-UHFFFAOYSA-N
• XLogP: 12.34
• TPSA: 354.11 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 16
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1488.88
LogP ≤ 5	12.34
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine?

The IUPAC name of 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine (CID 160793567) is 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine.

What is the SMILES notation for 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine?

The canonical SMILES for 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine is Cc1ncc(-c2ccc(S(=O)(=O)C3CCCNC3)cc2)nc1-c1cc(-c2ccsc2)no1.Cc1ncc(-c2ccc(S(=O)(=O)C3CCCNC3)cc2)nc1-c1cc(-c2nccs2)no1.Nc1ncc(-c2ccc(S(=O)(=O)C3CCCNC3)cc2)nc1-c1cc(-c2ccc(C3COCCN3)cc2)no1.[H][H].[H][H].[H][H].[H][H].

What is the InChIKey of 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine?

The InChIKey is SCDIVQUZBLZDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30N6O4S.C23H22N4O3S2.C22H21N5O3S2.4H2/c29-28-27(26-14-23(34-38-26)18-3-5-20(6-4-18)25-17-37-13-12-31-25)33-24(16-32-28)19-7-9-21(10-8-19)39(35,36)22-2-1-11-30-15-22;1-15-23(22-11-20(27-30-22)17-8-10-31-14-17)26-21(13-25-15)16-4-6-18(7-5-16)32(28,29)19-3-2-9-24-12-19;1-14-21(20-11-18(27-30-20)22-24-9-10-31-22)26-19(13-25-14)15-4-6-16(7-5-15)32(28,29)17-3-2-8-23-12-17;;;;/h3-10,14,16,22,25,30-31H,1-2,11-13,15,17H2,(H2,29,32);4-8,10-11,13-14,19,24H,2-3,9,12H2,1H3;4-7,9-11,13,17,23H,2-3,8,12H2,1H3;4*1H.

What are the key properties of 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine?

5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine has a molecular weight of 1488.88 g/mol, XLogP of 12.34, 16 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-(1,3-thiazol-2-yl)-1,2-oxazole;5-[3-methyl-6-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-yl]-3-thiophen-3-yl-1,2-oxazole;molecular hydrogen;3-[3-(4-morpholin-3-ylphenyl)-1,2-oxazol-5-yl]-5-(4-piperidin-3-ylsulfonylphenyl)pyrazin-2-amine is sourced from PubChem (CID 160793567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).