6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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

C122H129N23O9S17 — CID 161061741

IUPAC6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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
SMILESCC(C)S(=O)c1sc2nc(-c3ncco3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1cc2c(-c3ccccc3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1cc2c(N3CCCCC3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1sc2nc(-c3nccs3)cc(-c3cccnc3)c2c1N.CCCS(=O)c1sc2nc(-c3nccs3)cc(C)c2c1N.CCCS(=O)c1sc2nc(N3CCOCC3)nc(C)c2c1N.Cc1nc(-c2nccs2)nc2sc(S(=O)C(C)C)c(N)c12
InChIInChI=1S/C22H20N2OS2.C21H25N3OS2.C19H18N4OS3.C19H17N3O2S2.C14H20N4O2S2.C14H15N3OS3.C13H14N4OS3/c1-2-3-14-27(25)19-15-18-20(16-10-6-4-7-11-16)23-21(24-22(18)26-19)17-12-8-5-9-13-17;1-2-3-14-27(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;1-2-3-9-27(24)19-16(20)15-13(12-5-4-6-21-11-12)10-14(23-18(15)26-19)17-22-7-8-25-17;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)13-11(15)10-9(2)16-14(17-12(10)21-13)18-4-6-20-7-5-18;1-3-6-21(18)14-11(15)10-8(2)7-9(17-13(10)20-14)12-16-4-5-19-12;1-6(2)21(18)13-9(14)8-7(3)16-10(17-11(8)20-13)12-15-4-5-19-12/h4-13,15H,2-3,14H2,1H3;4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3;4-8,10-11H,2-3,9,20H2,1H3;3-11H,20H2,1-2H3;3-8,15H2,1-2H3;4-5,7H,3,6,15H2,1-2H3;4-6H,14H2,1-3H3
InChIKeyUDMGORQROFDCLY-UHFFFAOYSA-N
MW2606.66 g/mol
LogP29.86
Rot. Bonds33

About 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 161061741) has the molecular formula C122H129N23O9S17 and a molecular weight of 2606.66 g/mol. Its IUPAC name is 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 Name6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 CID161061741
Molecular FormulaC122H129N23O9S17
Molecular Weight2606.66 g/mol
Exact Mass2603.56
IUPAC Name6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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
SMILESCC(C)S(=O)c1sc2nc(-c3ncco3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1cc2c(-c3ccccc3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1cc2c(N3CCCCC3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1sc2nc(-c3nccs3)cc(-c3cccnc3)c2c1N.CCCS(=O)c1sc2nc(-c3nccs3)cc(C)c2c1N.CCCS(=O)c1sc2nc(N3CCOCC3)nc(C)c2c1N.Cc1nc(-c2nccs2)nc2sc(S(=O)C(C)C)c(N)c12
InChIInChI=1S/C22H20N2OS2.C21H25N3OS2.C19H18N4OS3.C19H17N3O2S2.C14H20N4O2S2.C14H15N3OS3.C13H14N4OS3/c1-2-3-14-27(25)19-15-18-20(16-10-6-4-7-11-16)23-21(24-22(18)26-19)17-12-8-5-9-13-17;1-2-3-14-27(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;1-2-3-9-27(24)19-16(20)15-13(12-5-4-6-21-11-12)10-14(23-18(15)26-19)17-22-7-8-25-17;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)13-11(15)10-9(2)16-14(17-12(10)21-13)18-4-6-20-7-5-18;1-3-6-21(18)14-11(15)10-8(2)7-9(17-13(10)20-14)12-16-4-5-19-12;1-6(2)21(18)13-9(14)8-7(3)16-10(17-11(8)20-13)12-15-4-5-19-12/h4-13,15H,2-3,14H2,1H3;4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3;4-8,10-11H,2-3,9,20H2,1H3;3-11H,20H2,1-2H3;3-8,15H2,1-2H3;4-5,7H,3,6,15H2,1-2H3;4-6H,14H2,1-3H3
InChIKeyUDMGORQROFDCLY-UHFFFAOYSA-N
XLogP29.86
TPSA484.68 Ų
H-Bond Donors5
H-Bond Acceptors42
Rotatable Bonds33
Heavy Atoms171
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002606.66
LogP ≤ 529.86
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1042

Analyze 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 161061741) is 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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(-c3ccccc3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1cc2c(N3CCCCC3)nc(-c3ccccc3)nc2s1.CCCCS(=O)c1sc2nc(-c3nccs3)cc(-c3cccnc3)c2c1N.CCCS(=O)c1sc2nc(-c3nccs3)cc(C)c2c1N.CCCS(=O)c1sc2nc(N3CCOCC3)nc(C)c2c1N.Cc1nc(-c2nccs2)nc2sc(S(=O)C(C)C)c(N)c12.
What is the InChIKey of 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 UDMGORQROFDCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2OS2.C21H25N3OS2.C19H18N4OS3.C19H17N3O2S2.C14H20N4O2S2.C14H15N3OS3.C13H14N4OS3/c1-2-3-14-27(25)19-15-18-20(16-10-6-4-7-11-16)23-21(24-22(18)26-19)17-12-8-5-9-13-17;1-2-3-14-27(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;1-2-3-9-27(24)19-16(20)15-13(12-5-4-6-21-11-12)10-14(23-18(15)26-19)17-22-7-8-25-17;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)13-11(15)10-9(2)16-14(17-12(10)21-13)18-4-6-20-7-5-18;1-3-6-21(18)14-11(15)10-8(2)7-9(17-13(10)20-14)12-16-4-5-19-12;1-6(2)21(18)13-9(14)8-7(3)16-10(17-11(8)20-13)12-15-4-5-19-12/h4-13,15H,2-3,14H2,1H3;4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3;4-8,10-11H,2-3,9,20H2,1H3;3-11H,20H2,1-2H3;3-8,15H2,1-2H3;4-5,7H,3,6,15H2,1-2H3;4-6H,14H2,1-3H3.
What are the key properties of 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 2606.66 g/mol, XLogP of 29.86, 33 rotatable bonds, 5 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butylsulfinyl-2,4-diphenylthieno[2,3-d]pyrimidine;6-butylsulfinyl-2-phenyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine;2-butylsulfinyl-4-pyridin-3-yl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-amine;4-methyl-2-morpholin-4-yl-6-propylsulfinylthieno[2,3-d]pyrimidin-5-amine;4-methyl-6-propan-2-ylsulfinyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-5-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 161061741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).