6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine

C97H107N17O8S15 — CID 157455140

About 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine

6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine (PubChem CID 157455140) has the molecular formula C97H107N17O8S15 and a molecular weight of 2120.04 g/mol. Its IUPAC name is 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine.

Molecular Properties

• Compound Name: 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine
• PubChem CID: 157455140
• Molecular Formula: C97H107N17O8S15
• Molecular Weight: 2120.04 g/mol
• Exact Mass: 2117.43
• IUPAC Name: 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine
• SMILES: CC(C)S(=O)c1sc2nc(-c3ncco3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1cc2c(N3CCCCC3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1nc2ccc(-c3cccs3)nc2s1.CCCS(=O)c1sc2nc(-c3nccs3)cc(C)c2c1N.CCCS(=O)c1sc2nc(N3CCOCC3)cc(C)c2c1N.Cc1cc(-c2nccs2)nc2sc(S(=O)C(C)C)c(N)c12
• InChI: InChI=1S/C21H25N3OS2.C19H17N3O2S2.C15H21N3O2S2.2C14H15N3OS3.C14H14N2OS3/c1-2-3-14-27(25)18-15-17-20(24-12-8-5-9-13-24)22-19(23-21(17)26-18)16-10-6-4-7-11-16;1-11(2)26(23)19-16(20)15-13(12-6-4-3-5-7-12)10-14(22-18(15)25-19)17-21-8-9-24-17;1-3-8-22(19)15-13(16)12-10(2)9-11(17-14(12)21-15)18-4-6-20-7-5-18;1-7(2)21(18)14-11(15)10-8(3)6-9(17-13(10)20-14)12-16-4-5-19-12;1-3-6-21(18)14-11(15)10-8(2)7-9(17-13(10)20-14)12-16-4-5-19-12;1-2-3-9-20(17)14-16-11-7-6-10(15-13(11)19-14)12-5-4-8-18-12/h4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3;3-11H,20H2,1-2H3;9H,3-8,16H2,1-2H3;4-7H,15H2,1-3H3;4-5,7H,3,6,15H2,1-2H3;4-8H,2-3,9H2,1H3
• InChIKey: BTGMNIMEOCGJDC-UHFFFAOYSA-N
• XLogP: 24.50
• TPSA: 377.14 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 34
• Rotatable Bonds: 26
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2120.04
LogP ≤ 5	24.50
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine?

The IUPAC name of 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine (CID 157455140) is 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine.

What is the SMILES notation for 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine?

The canonical SMILES for 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine is CC(C)S(=O)c1sc2nc(-c3ncco3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1cc2c(N3CCCCC3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1nc2ccc(-c3cccs3)nc2s1.CCCS(=O)c1sc2nc(-c3nccs3)cc(C)c2c1N.CCCS(=O)c1sc2nc(N3CCOCC3)cc(C)c2c1N.Cc1cc(-c2nccs2)nc2sc(S(=O)C(C)C)c(N)c12.

What is the InChIKey of 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine?

The InChIKey is BTGMNIMEOCGJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3OS2.C19H17N3O2S2.C15H21N3O2S2.2C14H15N3OS3.C14H14N2OS3/c1-2-3-14-27(25)18-15-17-20(24-12-8-5-9-13-24)22-19(23-21(17)26-18)16-10-6-4-7-11-16;1-11(2)26(23)19-16(20)15-13(12-6-4-3-5-7-12)10-14(22-18(15)25-19)17-21-8-9-24-17;1-3-8-22(19)15-13(16)12-10(2)9-11(17-14(12)21-15)18-4-6-20-7-5-18;1-7(2)21(18)14-11(15)10-8(3)6-9(17-13(10)20-14)12-16-4-5-19-12;1-3-6-21(18)14-11(15)10-8(2)7-9(17-13(10)20-14)12-16-4-5-19-12;1-2-3-9-20(17)14-16-11-7-6-10(15-13(11)19-14)12-5-4-8-18-12/h4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3;3-11H,20H2,1-2H3;9H,3-8,16H2,1-2H3;4-7H,15H2,1-3H3;4-5,7H,3,6,15H2,1-2H3;4-8H,2-3,9H2,1H3.

What are the key properties of 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine?

6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine has a molecular weight of 2120.04 g/mol, XLogP of 24.50, 26 rotatable bonds, 4 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-5-thiophen-2-yl-[1,3]thiazolo[5,4-b]pyridine;4-methyl-6-morpholin-4-yl-2-propylsulfinylthieno[2,3-b]pyridin-3-amine;4-methyl-2-propan-2-ylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-propylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;6-(1,3-oxazol-2-yl)-4-phenyl-2-propan-2-ylsulfinylthieno[2,3-b]pyridin-3-amine is sourced from PubChem (CID 157455140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).