6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine

C111H112FN21O5S10 — CID 157167058

About 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine

6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine (PubChem CID 157167058) has the molecular formula C111H112FN21O5S10 and a molecular weight of 2159.93 g/mol. Its IUPAC name is 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine.

Molecular Properties

• Compound Name: 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine
• PubChem CID: 157167058
• Molecular Formula: C111H112FN21O5S10
• Molecular Weight: 2159.93 g/mol
• Exact Mass: 2157.63
• IUPAC Name: 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine
• SMILES: CCCC[S@@](=O)c1sc2nc(-c3ccc(N)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@@](=O)c1sc2nc(-c3cnc(CC)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@](=O)c1sc2nc(-c3ccc(N)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@](=O)c1sc2nc(-c3cnc(CC)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@](=O)c1sc2nc(-c3cnc(N)nc3)cc(-c3ccc(F)cc3)c2c1N
• InChI: InChI=1S/2C23H24N4OS2.2C22H22N4OS2.C21H20FN5OS2/c2*1-3-5-11-30(28)23-21(24)20-17(15-9-7-6-8-10-15)12-18(27-22(20)29-23)16-13-25-19(4-2)26-14-16;2*1-2-3-11-29(27)22-20(24)19-16(14-7-5-4-6-8-14)12-17(26-21(19)28-22)15-9-10-18(23)25-13-15;1-2-3-8-30(28)20-18(23)17-15(12-4-6-14(22)7-5-12)9-16(27-19(17)29-20)13-10-25-21(24)26-11-13/h2*6-10,12-14H,3-5,11,24H2,1-2H3;2*4-10,12-13H,2-3,11,24H2,1H3,(H2,23,25);4-7,9-11H,2-3,8,23H2,1H3,(H2,24,25,26)/t2*30-;2*29-;30-/m10100/s1
• InChIKey: ANAQDRLANJDMPG-BVLFQISNSA-N
• XLogP: 25.77
• TPSA: 461.08 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 31
• Rotatable Bonds: 32
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2159.93
LogP ≤ 5	25.77
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine?

The IUPAC name of 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine (CID 157167058) is 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine.

What is the SMILES notation for 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine?

The canonical SMILES for 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine is CCCC[S@@](=O)c1sc2nc(-c3ccc(N)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@@](=O)c1sc2nc(-c3cnc(CC)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@](=O)c1sc2nc(-c3ccc(N)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@](=O)c1sc2nc(-c3cnc(CC)nc3)cc(-c3ccccc3)c2c1N.CCCC[S@](=O)c1sc2nc(-c3cnc(N)nc3)cc(-c3ccc(F)cc3)c2c1N.

What is the InChIKey of 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine?

The InChIKey is ANAQDRLANJDMPG-BVLFQISNSA-N. The full InChI is InChI=1S/2C23H24N4OS2.2C22H22N4OS2.C21H20FN5OS2/c2*1-3-5-11-30(28)23-21(24)20-17(15-9-7-6-8-10-15)12-18(27-22(20)29-23)16-13-25-19(4-2)26-14-16;2*1-2-3-11-29(27)22-20(24)19-16(14-7-5-4-6-8-14)12-17(26-21(19)28-22)15-9-10-18(23)25-13-15;1-2-3-8-30(28)20-18(23)17-15(12-4-6-14(22)7-5-12)9-16(27-19(17)29-20)13-10-25-21(24)26-11-13/h2*6-10,12-14H,3-5,11,24H2,1-2H3;2*4-10,12-13H,2-3,11,24H2,1H3,(H2,23,25);4-7,9-11H,2-3,8,23H2,1H3,(H2,24,25,26)/t2*30-;2*29-;30-/m10100/s1.

What are the key properties of 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine?

6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine has a molecular weight of 2159.93 g/mol, XLogP of 25.77, 32 rotatable bonds, 8 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(6-amino-3-pyridinyl)-2-[(S)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(6-amino-3-pyridinyl)-2-[(R)-butylsulfinyl]-4-phenylthieno[2,3-b]pyridin-3-amine;6-(2-aminopyrimidin-5-yl)-2-[(S)-butylsulfinyl]-4-(4-fluorophenyl)thieno[2,3-b]pyridin-3-amine;2-[(S)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine;2-[(R)-butylsulfinyl]-6-(2-ethylpyrimidin-5-yl)-4-phenylthieno[2,3-b]pyridin-3-amine is sourced from PubChem (CID 157167058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).