N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide

C121H99BrClF2N27O11S6 — CID 161039652

About N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide

N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide (PubChem CID 161039652) has the molecular formula C121H99BrClF2N27O11S6 and a molecular weight of 2453.06 g/mol. Its IUPAC name is N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide.

Molecular Properties

• Compound Name: N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide
• PubChem CID: 161039652
• Molecular Formula: C121H99BrClF2N27O11S6
• Molecular Weight: 2453.06 g/mol
• Exact Mass: 2449.52
• IUPAC Name: N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide
• SMILES: CC(=O)Cc1cc(-c2nc(-c3ccc(NC(C)=O)cc3)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc(-c2nc(-c3ccc(F)cc3F)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc(-c2nc(-c3ccc(Oc4ccccc4)cc3)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc(-c2nc(Br)c(-c3ncc[nH]3)s2)ccn1.COCCCC(=O)c1sc(-c2ccnc(NC(C)=O)c2)nc1-c1ccccc1Cl.COc1ccc(-c2nc(-c3ccnc(CC(C)=O)c3)sc2-c2ncc[nH]2)cc1
• InChI: InChI=1S/C25H19N5O2S.C22H19N5O2S.C21H20ClN3O3S.C21H18N4O2S.C19H13F2N5OS.C13H10BrN5OS/c1-16(31)29-21-15-18(11-12-26-21)25-30-22(23(33-25)24-27-13-14-28-24)17-7-9-20(10-8-17)32-19-5-3-2-4-6-19;1-13(28)11-18-12-16(7-8-23-18)22-27-19(20(30-22)21-24-9-10-25-21)15-3-5-17(6-4-15)26-14(2)29;1-13(26)24-18-12-14(9-10-23-18)21-25-19(15-6-3-4-7-16(15)22)20(29-21)17(27)8-5-11-28-2;1-13(26)11-16-12-15(7-8-22-16)21-25-18(14-3-5-17(27-2)6-4-14)19(28-21)20-23-9-10-24-20;1-10(27)25-15-8-11(4-5-22-15)19-26-16(13-3-2-12(20)9-14(13)21)17(28-19)18-23-6-7-24-18;1-7(20)18-9-6-8(2-3-15-9)13-19-11(14)10(21-13)12-16-4-5-17-12/h2-15H,1H3,(H,27,28)(H,26,29,31);3-10,12H,11H2,1-2H3,(H,24,25)(H,26,29);3-4,6-7,9-10,12H,5,8,11H2,1-2H3,(H,23,24,26);3-10,12H,11H2,1-2H3,(H,23,24);2-9H,1H3,(H,23,24)(H,22,25,27);2-6H,1H3,(H,16,17)(H,15,18,20)
• InChIKey: UASGMCQCYNQLIG-UHFFFAOYSA-N
• XLogP: 27.68
• TPSA: 522.48 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 34
• Rotatable Bonds: 33
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2453.06
LogP ≤ 5	27.68
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide?

The IUPAC name of N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide (CID 161039652) is N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide.

What is the SMILES notation for N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide?

The canonical SMILES for N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide is CC(=O)Cc1cc(-c2nc(-c3ccc(NC(C)=O)cc3)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc(-c2nc(-c3ccc(F)cc3F)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc(-c2nc(-c3ccc(Oc4ccccc4)cc3)c(-c3ncc[nH]3)s2)ccn1.CC(=O)Nc1cc(-c2nc(Br)c(-c3ncc[nH]3)s2)ccn1.COCCCC(=O)c1sc(-c2ccnc(NC(C)=O)c2)nc1-c1ccccc1Cl.COc1ccc(-c2nc(-c3ccnc(CC(C)=O)c3)sc2-c2ncc[nH]2)cc1.

What is the InChIKey of N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide?

The InChIKey is UASGMCQCYNQLIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N5O2S.C22H19N5O2S.C21H20ClN3O3S.C21H18N4O2S.C19H13F2N5OS.C13H10BrN5OS/c1-16(31)29-21-15-18(11-12-26-21)25-30-22(23(33-25)24-27-13-14-28-24)17-7-9-20(10-8-17)32-19-5-3-2-4-6-19;1-13(28)11-18-12-16(7-8-23-18)22-27-19(20(30-22)21-24-9-10-25-21)15-3-5-17(6-4-15)26-14(2)29;1-13(26)24-18-12-14(9-10-23-18)21-25-19(15-6-3-4-7-16(15)22)20(29-21)17(27)8-5-11-28-2;1-13(26)11-16-12-15(7-8-22-16)21-25-18(14-3-5-17(27-2)6-4-14)19(28-21)20-23-9-10-24-20;1-10(27)25-15-8-11(4-5-22-15)19-26-16(13-3-2-12(20)9-14(13)21)17(28-19)18-23-6-7-24-18;1-7(20)18-9-6-8(2-3-15-9)13-19-11(14)10(21-13)12-16-4-5-17-12/h2-15H,1H3,(H,27,28)(H,26,29,31);3-10,12H,11H2,1-2H3,(H,24,25)(H,26,29);3-4,6-7,9-10,12H,5,8,11H2,1-2H3,(H,23,24,26);3-10,12H,11H2,1-2H3,(H,23,24);2-9H,1H3,(H,23,24)(H,22,25,27);2-6H,1H3,(H,16,17)(H,15,18,20).

What are the key properties of N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide?

N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide has a molecular weight of 2453.06 g/mol, XLogP of 27.68, 33 rotatable bonds, 10 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[4-bromo-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methoxybutanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-difluorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-2-[2-(2-oxopropyl)-4-pyridinyl]-1,3-thiazol-4-yl]phenyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide is sourced from PubChem (CID 161039652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).