4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone

C93H77N23O2S4 — CID 158608466

About 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone

4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone (PubChem CID 158608466) has the molecular formula C93H77N23O2S4 and a molecular weight of 1677.07 g/mol. Its IUPAC name is 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone.

Molecular Properties

• Compound Name: 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone
• PubChem CID: 158608466
• Molecular Formula: C93H77N23O2S4
• Molecular Weight: 1677.07 g/mol
• Exact Mass: 1675.55
• IUPAC Name: 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone
• SMILES: CC(=O)c1cccc(-c2nc(-c3c(C)nn4ccccc34)sc2C2=NCC=N2)c1.Cc1cc(C)cc(-c2nc(-c3c(C)nn4ccccc34)sc2C2=NCC=N2)c1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2Oc2ccccc2)c(C2=NCC=N2)s1.Cc1nn2ccccc2c1-c1nc(-c2cccnc2N2CCNCC2)c(C2=NCC=N2)s1
• InChI: InChI=1S/C26H19N5OS.C23H22N8S.C22H17N5OS.C22H19N5S/c1-17-22(20-12-7-8-16-31(20)30-17)26-29-23(24(33-26)25-27-14-15-28-25)19-11-5-6-13-21(19)32-18-9-3-2-4-10-18;1-15-18(17-6-2-3-12-31(17)29-15)23-28-19(20(32-23)21-25-8-9-26-21)16-5-4-7-27-22(16)30-13-10-24-11-14-30;1-13-18(17-8-3-4-11-27(17)26-13)22-25-19(20(29-22)21-23-9-10-24-21)16-7-5-6-15(12-16)14(2)28;1-13-10-14(2)12-16(11-13)19-20(21-23-7-8-24-21)28-22(25-19)18-15(3)26-27-9-5-4-6-17(18)27/h2-14,16H,15H2,1H3;2-8,12,24H,9-11,13-14H2,1H3;3-9,11-12H,10H2,1-2H3;4-7,9-12H,8H2,1-3H3
• InChIKey: HWNLJZFOJYRPBJ-UHFFFAOYSA-N
• XLogP: 18.47
• TPSA: 274.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 29
• Rotatable Bonds: 16
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1677.07
LogP ≤ 5	18.47
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone?

The IUPAC name of 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone (CID 158608466) is 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone.

What is the SMILES notation for 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone?

The canonical SMILES for 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone is CC(=O)c1cccc(-c2nc(-c3c(C)nn4ccccc34)sc2C2=NCC=N2)c1.Cc1cc(C)cc(-c2nc(-c3c(C)nn4ccccc34)sc2C2=NCC=N2)c1.Cc1nn2ccccc2c1-c1nc(-c2ccccc2Oc2ccccc2)c(C2=NCC=N2)s1.Cc1nn2ccccc2c1-c1nc(-c2cccnc2N2CCNCC2)c(C2=NCC=N2)s1.

What is the InChIKey of 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone?

The InChIKey is HWNLJZFOJYRPBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N5OS.C23H22N8S.C22H17N5OS.C22H19N5S/c1-17-22(20-12-7-8-16-31(20)30-17)26-29-23(24(33-26)25-27-14-15-28-25)19-11-5-6-13-21(19)32-18-9-3-2-4-10-18;1-15-18(17-6-2-3-12-31(17)29-15)23-28-19(20(32-23)21-25-8-9-26-21)16-5-4-7-27-22(16)30-13-10-24-11-14-30;1-13-18(17-8-3-4-11-27(17)26-13)22-25-19(20(29-22)21-23-9-10-24-21)16-7-5-6-15(12-16)14(2)28;1-13-10-14(2)12-16(11-13)19-20(21-23-7-8-24-21)28-22(25-19)18-15(3)26-27-9-5-4-6-17(18)27/h2-14,16H,15H2,1H3;2-8,12,24H,9-11,13-14H2,1H3;3-9,11-12H,10H2,1-2H3;4-7,9-12H,8H2,1-3H3.

What are the key properties of 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone?

4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone has a molecular weight of 1677.07 g/mol, XLogP of 18.47, 16 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(3,5-dimethylphenyl)-5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-phenoxyphenyl)-1,3-thiazole;5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-4-(2-piperazin-1-yl-3-pyridinyl)-1,3-thiazole;1-[3-[5-(4H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazol-4-yl]phenyl]ethanone is sourced from PubChem (CID 158608466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).