2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid
C142H117BrN30O14S9 — CID 158450380
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid
SMILESCc1c(C(=O)N2CCC(C)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.Cc1c(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.Cc1c(C(=O)N2CCC(c3nc4ccccc4s3)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.O=C(O)c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1.O=C(c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1)N1CCC(c2c[nH]c3ccccc23)CC1.O=C(c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1)N1CCC(c2nc3ccccc3s2)CC1.O=c1[nH]c(-c2ccc(Br)cn2)nc2ccsc12
InChIInChI=1S/C26H23N5O2S.C25H21N5O2S2.C25H21N5O2S.C24H19N5O2S2.C19H20N4O2S.C12H7N3O3S.C11H6BrN3OS/c1-15-17(6-10-27-22(15)24-29-21-9-13-34-23(21)25(32)30-24)26(33)31-11-7-16(8-12-31)19-14-28-20-5-3-2-4-18(19)20;1-14-16(6-10-26-20(14)22-27-18-9-13-33-21(18)23(31)29-22)25(32)30-11-7-15(8-12-30)24-28-17-4-2-3-5-19(17)34-24;31-24-22-20(8-12-33-22)28-23(29-24)21-13-16(5-9-26-21)25(32)30-10-6-15(7-11-30)18-14-27-19-4-2-1-3-17(18)19;30-22-20-17(8-12-32-20)26-21(28-22)18-13-15(5-9-25-18)24(31)29-10-6-14(7-11-29)23-27-16-3-1-2-4-19(16)33-23;1-11-4-8-23(9-5-11)19(25)13-3-7-20-15(12(13)2)17-21-14-6-10-26-16(14)18(24)22-17;16-11-9-7(2-4-19-9)14-10(15-11)8-5-6(12(17)18)1-3-13-8;12-6-1-2-8(13-5-6)10-14-7-3-4-17-9(7)11(16)15-10/h2-6,9-10,13-14,16,28H,7-8,11-12H2,1H3,(H,29,30,32);2-6,9-10,13,15H,7-8,11-12H2,1H3,(H,27,29,31);1-5,8-9,12-15,27H,6-7,10-11H2,(H,28,29,31);1-5,8-9,12-14H,6-7,10-11H2,(H,26,28,30);3,6-7,10-11H,4-5,8-9H2,1-2H3,(H,21,22,24);1-5H,(H,17,18)(H,14,15,16);1-5H,(H,14,15,16)
InChIKeyHDXHCAWSZNQYCE-UHFFFAOYSA-N
MW2836.20 g/mol
LogP26.85
Rot. Bonds17
About 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid
2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid (PubChem CID 158450380) has the molecular formula C142H117BrN30O14S9 and a molecular weight of 2836.20 g/mol. Its IUPAC name is 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid.
Molecular Properties
| Compound Name | 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid |
|---|---|
| PubChem CID | 158450380 |
| Molecular Formula | C142H117BrN30O14S9 |
| Molecular Weight | 2836.20 g/mol |
| Exact Mass | 2832.60 |
| IUPAC Name | 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid |
| SMILES | Cc1c(C(=O)N2CCC(C)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.Cc1c(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.Cc1c(C(=O)N2CCC(c3nc4ccccc4s3)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.O=C(O)c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1.O=C(c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1)N1CCC(c2c[nH]c3ccccc23)CC1.O=C(c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1)N1CCC(c2nc3ccccc3s2)CC1.O=c1[nH]c(-c2ccc(Br)cn2)nc2ccsc12 |
| InChI | InChI=1S/C26H23N5O2S.C25H21N5O2S2.C25H21N5O2S.C24H19N5O2S2.C19H20N4O2S.C12H7N3O3S.C11H6BrN3OS/c1-15-17(6-10-27-22(15)24-29-21-9-13-34-23(21)25(32)30-24)26(33)31-11-7-16(8-12-31)19-14-28-20-5-3-2-4-18(19)20;1-14-16(6-10-26-20(14)22-27-18-9-13-33-21(18)23(31)29-22)25(32)30-11-7-15(8-12-30)24-28-17-4-2-3-5-19(17)34-24;31-24-22-20(8-12-33-22)28-23(29-24)21-13-16(5-9-26-21)25(32)30-10-6-15(7-11-30)18-14-27-19-4-2-1-3-17(18)19;30-22-20-17(8-12-32-20)26-21(28-22)18-13-15(5-9-25-18)24(31)29-10-6-14(7-11-29)23-27-16-3-1-2-4-19(16)33-23;1-11-4-8-23(9-5-11)19(25)13-3-7-20-15(12(13)2)17-21-14-6-10-26-16(14)18(24)22-17;16-11-9-7(2-4-19-9)14-10(15-11)8-5-6(12(17)18)1-3-13-8;12-6-1-2-8(13-5-6)10-14-7-3-4-17-9(7)11(16)15-10/h2-6,9-10,13-14,16,28H,7-8,11-12H2,1H3,(H,29,30,32);2-6,9-10,13,15H,7-8,11-12H2,1H3,(H,27,29,31);1-5,8-9,12-15,27H,6-7,10-11H2,(H,28,29,31);1-5,8-9,12-14H,6-7,10-11H2,(H,26,28,30);3,6-7,10-11H,4-5,8-9H2,1-2H3,(H,21,22,24);1-5H,(H,17,18)(H,14,15,16);1-5H,(H,14,15,16) |
| InChIKey | HDXHCAWSZNQYCE-UHFFFAOYSA-N |
| XLogP | 26.85 |
| TPSA | 606.69 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 38 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 196 |
| Complexity | — |
Lipinski Rule of Five
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2836.20 |
| LogP ≤ 5 | 26.85 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 38 |
Frequently Asked Questions
What is the IUPAC name of 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid?
The IUPAC name of 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid (CID 158450380) is 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid.
What is the SMILES notation for 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid?
The canonical SMILES for 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid is Cc1c(C(=O)N2CCC(C)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.Cc1c(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.Cc1c(C(=O)N2CCC(c3nc4ccccc4s3)CC2)ccnc1-c1nc2ccsc2c(=O)[nH]1.O=C(O)c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1.O=C(c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1)N1CCC(c2c[nH]c3ccccc23)CC1.O=C(c1ccnc(-c2nc3ccsc3c(=O)[nH]2)c1)N1CCC(c2nc3ccccc3s2)CC1.O=c1[nH]c(-c2ccc(Br)cn2)nc2ccsc12.
What is the InChIKey of 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid?
The InChIKey is HDXHCAWSZNQYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N5O2S.C25H21N5O2S2.C25H21N5O2S.C24H19N5O2S2.C19H20N4O2S.C12H7N3O3S.C11H6BrN3OS/c1-15-17(6-10-27-22(15)24-29-21-9-13-34-23(21)25(32)30-24)26(33)31-11-7-16(8-12-31)19-14-28-20-5-3-2-4-18(19)20;1-14-16(6-10-26-20(14)22-27-18-9-13-33-21(18)23(31)29-22)25(32)30-11-7-15(8-12-30)24-28-17-4-2-3-5-19(17)34-24;31-24-22-20(8-12-33-22)28-23(29-24)21-13-16(5-9-26-21)25(32)30-10-6-15(7-11-30)18-14-27-19-4-2-1-3-17(18)19;30-22-20-17(8-12-32-20)26-21(28-22)18-13-15(5-9-25-18)24(31)29-10-6-14(7-11-29)23-27-16-3-1-2-4-19(16)33-23;1-11-4-8-23(9-5-11)19(25)13-3-7-20-15(12(13)2)17-21-14-6-10-26-16(14)18(24)22-17;16-11-9-7(2-4-19-9)14-10(15-11)8-5-6(12(17)18)1-3-13-8;12-6-1-2-8(13-5-6)10-14-7-3-4-17-9(7)11(16)15-10/h2-6,9-10,13-14,16,28H,7-8,11-12H2,1H3,(H,29,30,32);2-6,9-10,13,15H,7-8,11-12H2,1H3,(H,27,29,31);1-5,8-9,12-15,27H,6-7,10-11H2,(H,28,29,31);1-5,8-9,12-14H,6-7,10-11H2,(H,26,28,30);3,6-7,10-11H,4-5,8-9H2,1-2H3,(H,21,22,24);1-5H,(H,17,18)(H,14,15,16);1-5H,(H,14,15,16).
What are the key properties of 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid?
2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid has a molecular weight of 2836.20 g/mol, XLogP of 26.85, 17 rotatable bonds, 10 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(5-bromo-2-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-3-methyl-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[4-[4-(1H-indol-3-yl)piperidine-1-carbonyl]-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-[3-methyl-4-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]-3H-thieno[3,2-d]pyrimidin-4-one;2-(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)pyridine-4-carboxylic acid is sourced from PubChem (CID 158450380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 158450380 — identifiers, structure, computed properties (public domain)
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