7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one

C86H73N19O9S4 — CID 158325498

About 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one

7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one (PubChem CID 158325498) has the molecular formula C86H73N19O9S4 and a molecular weight of 1644.92 g/mol. Its IUPAC name is 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one.

Molecular Properties

• Compound Name: 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one
• PubChem CID: 158325498
• Molecular Formula: C86H73N19O9S4
• Molecular Weight: 1644.92 g/mol
• Exact Mass: 1643.47
• IUPAC Name: 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one
• SMILES: Cc1c(C(=O)N2CCN(c3ccccc3)CC2)sc2c(=O)[nH]c(-c3ccccn3)nc12.O=C(NCCc1cccnc1)c1cc2nc(-c3ccccn3)[nH]c(=O)c2s1.O=C(c1cc2nc(-c3ccccn3)[nH]c(=O)c2s1)N1CCN(c2ccccc2)CC1.O=C(c1cc2nc(-c3ccccn3)[nH]c(=O)c2s1)N1CCOC(c2ccccc2)C1
• InChI: InChI=1S/C23H21N5O2S.C22H19N5O2S.C22H18N4O3S.C19H15N5O2S/c1-15-18-20(22(29)26-21(25-18)17-9-5-6-10-24-17)31-19(15)23(30)28-13-11-27(12-14-28)16-7-3-2-4-8-16;28-21-19-17(24-20(25-21)16-8-4-5-9-23-16)14-18(30-19)22(29)27-12-10-26(11-13-27)15-6-2-1-3-7-15;27-21-19-16(24-20(25-21)15-8-4-5-9-23-15)12-18(30-19)22(28)26-10-11-29-17(13-26)14-6-2-1-3-7-14;25-18(22-9-6-12-4-3-7-20-11-12)15-10-14-16(27-15)19(26)24-17(23-14)13-5-1-2-8-21-13/h2-10H,11-14H2,1H3,(H,25,26,29);1-9,14H,10-13H2,(H,24,25,28);1-9,12,17H,10-11,13H2,(H,24,25,27);1-5,7-8,10-11H,6,9H2,(H,22,25)(H,23,24,26)
• InChIKey: GPIWSPGYYAXTGH-UHFFFAOYSA-N
• XLogP: 12.00
• TPSA: 353.19 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 24
• Rotatable Bonds: 14
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1644.92
LogP ≤ 5	12.00
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one?

The IUPAC name of 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one (CID 158325498) is 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one.

What is the SMILES notation for 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one?

The canonical SMILES for 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one is Cc1c(C(=O)N2CCN(c3ccccc3)CC2)sc2c(=O)[nH]c(-c3ccccn3)nc12.O=C(NCCc1cccnc1)c1cc2nc(-c3ccccn3)[nH]c(=O)c2s1.O=C(c1cc2nc(-c3ccccn3)[nH]c(=O)c2s1)N1CCN(c2ccccc2)CC1.O=C(c1cc2nc(-c3ccccn3)[nH]c(=O)c2s1)N1CCOC(c2ccccc2)C1.

What is the InChIKey of 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one?

The InChIKey is GPIWSPGYYAXTGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O2S.C22H19N5O2S.C22H18N4O3S.C19H15N5O2S/c1-15-18-20(22(29)26-21(25-18)17-9-5-6-10-24-17)31-19(15)23(30)28-13-11-27(12-14-28)16-7-3-2-4-8-16;28-21-19-17(24-20(25-21)16-8-4-5-9-23-16)14-18(30-19)22(29)27-12-10-26(11-13-27)15-6-2-1-3-7-15;27-21-19-16(24-20(25-21)15-8-4-5-9-23-15)12-18(30-19)22(28)26-10-11-29-17(13-26)14-6-2-1-3-7-14;25-18(22-9-6-12-4-3-7-20-11-12)15-10-14-16(27-15)19(26)24-17(23-14)13-5-1-2-8-21-13/h2-10H,11-14H2,1H3,(H,25,26,29);1-9,14H,10-13H2,(H,24,25,28);1-9,12,17H,10-11,13H2,(H,24,25,27);1-5,7-8,10-11H,6,9H2,(H,22,25)(H,23,24,26).

What are the key properties of 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one?

7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one has a molecular weight of 1644.92 g/mol, XLogP of 12.00, 14 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 7-methyl-6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;4-oxo-2-pyridin-2-yl-N-(2-pyridin-3-ylethyl)-3H-thieno[3,2-d]pyrimidine-6-carboxamide;6-(2-phenylmorpholine-4-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one;6-(4-phenylpiperazine-1-carbonyl)-2-pyridin-2-yl-3H-thieno[3,2-d]pyrimidin-4-one is sourced from PubChem (CID 158325498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).