7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one

C92H76FN23O6S5 — CID 162069083

About 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one

7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one (PubChem CID 162069083) has the molecular formula C92H76FN23O6S5 and a molecular weight of 1779.11 g/mol. Its IUPAC name is 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one.

Molecular Properties

• Compound Name: 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one
• PubChem CID: 162069083
• Molecular Formula: C92H76FN23O6S5
• Molecular Weight: 1779.11 g/mol
• Exact Mass: 1777.49
• IUPAC Name: 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one
• SMILES: CC(F)c1cncc(-c2csc3c(=O)[nH]c(-c4ccccn4)nc23)c1.Cc1c(-c2csc3c(=O)[nH]c(-c4ccccn4)nc23)cnn1C.Cc1nn(C(C)C)cc1-c1csc2c(=O)[nH]c(-c3ccccn3)nc12.Cc1sc2c(=O)[nH]c(-c3ccccn3)nc2c1-c1ccncc1.Cc1sc2c(=O)[nH]c(-c3ccccn3)nc2c1C(=O)N1CCN(c2ccccc2)CC1
• InChI: InChI=1S/C23H21N5O2S.C18H13FN4OS.C18H17N5OS.C17H12N4OS.C16H13N5OS/c1-15-18(23(30)28-13-11-27(12-14-28)16-7-3-2-4-8-16)19-20(31-15)22(29)26-21(25-19)17-9-5-6-10-24-17;1-10(19)11-6-12(8-20-7-11)13-9-25-16-15(13)22-17(23-18(16)24)14-4-2-3-5-21-14;1-10(2)23-8-12(11(3)22-23)13-9-25-16-15(13)20-17(21-18(16)24)14-6-4-5-7-19-14;1-10-13(11-5-8-18-9-6-11)14-15(23-10)17(22)21-16(20-14)12-4-2-3-7-19-12;1-9-10(7-18-21(9)2)11-8-23-14-13(11)19-15(20-16(14)22)12-5-3-4-6-17-12/h2-10H,11-14H2,1H3,(H,25,26,29);2-10H,1H3,(H,22,23,24);4-10H,1-3H3,(H,20,21,24);2-9H,1H3,(H,20,21,22);3-8H,1-2H3,(H,19,20,22)
• InChIKey: ZAVKORZLNOVUOA-UHFFFAOYSA-N
• XLogP: 17.43
• TPSA: 378.17 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 28
• Rotatable Bonds: 13
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1779.11
LogP ≤ 5	17.43
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one?

The IUPAC name of 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one (CID 162069083) is 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one.

What is the SMILES notation for 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one?

The canonical SMILES for 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one is CC(F)c1cncc(-c2csc3c(=O)[nH]c(-c4ccccn4)nc23)c1.Cc1c(-c2csc3c(=O)[nH]c(-c4ccccn4)nc23)cnn1C.Cc1nn(C(C)C)cc1-c1csc2c(=O)[nH]c(-c3ccccn3)nc12.Cc1sc2c(=O)[nH]c(-c3ccccn3)nc2c1-c1ccncc1.Cc1sc2c(=O)[nH]c(-c3ccccn3)nc2c1C(=O)N1CCN(c2ccccc2)CC1.

What is the InChIKey of 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one?

The InChIKey is ZAVKORZLNOVUOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O2S.C18H13FN4OS.C18H17N5OS.C17H12N4OS.C16H13N5OS/c1-15-18(23(30)28-13-11-27(12-14-28)16-7-3-2-4-8-16)19-20(31-15)22(29)26-21(25-19)17-9-5-6-10-24-17;1-10(19)11-6-12(8-20-7-11)13-9-25-16-15(13)22-17(23-18(16)24)14-4-2-3-5-21-14;1-10(2)23-8-12(11(3)22-23)13-9-25-16-15(13)20-17(21-18(16)24)14-6-4-5-7-19-14;1-10-13(11-5-8-18-9-6-11)14-15(23-10)17(22)21-16(20-14)12-4-2-3-7-19-12;1-9-10(7-18-21(9)2)11-8-23-14-13(11)19-15(20-16(14)22)12-5-3-4-6-17-12/h2-10H,11-14H2,1H3,(H,25,26,29);2-10H,1H3,(H,22,23,24);4-10H,1-3H3,(H,20,21,24);2-9H,1H3,(H,20,21,22);3-8H,1-2H3,(H,19,20,22).

What are the key properties of 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one?

7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one has a molecular weight of 1779.11 g/mol, XLogP of 17.43, 13 rotatable bonds, 5 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(1,5-dimethylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-[5-(1-fluoroethyl)-3-pyridinyl]-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-7-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;7-(3-methyl-1-propan-2-ylpyrazol-4-yl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-methyl-2-pyridin-2-yl-7-pyridin-4-yl-3H-thieno[3,2-d]pyrimidin-4-one is sourced from PubChem (CID 162069083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).