4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole

C125H128Cl5F3N18O21S12 — CID 173105274

About 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole

4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole (PubChem CID 173105274) has the molecular formula C125H128Cl5F3N18O21S12 and a molecular weight of 2837.57 g/mol. Its IUPAC name is 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole.

Molecular Properties

• Compound Name: 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole
• PubChem CID: 173105274
• Molecular Formula: C125H128Cl5F3N18O21S12
• Molecular Weight: 2837.57 g/mol
• Exact Mass: 2832.45
• IUPAC Name: 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole
• SMILES: COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(C)cc(C)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(Cl)cc(Cl)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(F)cc(Cl)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(OC)c(OC)c(OC)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4ccc(Cl)c(F)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4ccc(F)c(Cl)c4)cs3)CC2)cc1
• InChI: InChI=1S/C23H27N3O6S2.C22H25N3O3S2.C20H19Cl2N3O3S2.3C20H19ClFN3O3S2/c1-29-17-5-7-18(8-6-17)34(27,28)26-11-9-25(10-12-26)23-24-19(15-33-23)16-13-20(30-2)22(32-4)21(14-16)31-3;1-16-12-17(2)14-18(13-16)21-15-29-22(23-21)24-8-10-25(11-9-24)30(26,27)20-6-4-19(28-3)5-7-20;1-28-17-2-4-18(5-3-17)30(26,27)25-8-6-24(7-9-25)20-23-19(13-29-20)14-10-15(21)12-16(22)11-14;1-28-15-3-5-16(6-4-15)30(26,27)25-10-8-24(9-11-25)20-23-19(13-29-20)14-2-7-18(22)17(21)12-14;1-28-15-3-5-16(6-4-15)30(26,27)25-10-8-24(9-11-25)20-23-19(13-29-20)14-2-7-17(21)18(22)12-14;1-28-17-2-4-18(5-3-17)30(26,27)25-8-6-24(7-9-25)20-23-19(13-29-20)14-10-15(21)12-16(22)11-14/h5-8,13-15H,9-12H2,1-4H3;4-7,12-15H,8-11H2,1-3H3;2-5,10-13H,6-9H2,1H3;2*2-7,12-13H,8-11H2,1H3;2-5,10-13H,6-9H2,1H3
• InChIKey: JWLDVCWONQDNLM-UHFFFAOYSA-N
• XLogP: 24.30
• TPSA: 404.13 Ų
• H-Bond Acceptors: 39
• Rotatable Bonds: 33
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2837.57
LogP ≤ 5	24.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	39

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole?

The IUPAC name of 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole (CID 173105274) is 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole.

What is the SMILES notation for 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole?

The canonical SMILES for 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole is COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(C)cc(C)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(Cl)cc(Cl)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(F)cc(Cl)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4cc(OC)c(OC)c(OC)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4ccc(Cl)c(F)c4)cs3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCN(c3nc(-c4ccc(F)c(Cl)c4)cs3)CC2)cc1.

What is the InChIKey of 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole?

The InChIKey is JWLDVCWONQDNLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O6S2.C22H25N3O3S2.C20H19Cl2N3O3S2.3C20H19ClFN3O3S2/c1-29-17-5-7-18(8-6-17)34(27,28)26-11-9-25(10-12-26)23-24-19(15-33-23)16-13-20(30-2)22(32-4)21(14-16)31-3;1-16-12-17(2)14-18(13-16)21-15-29-22(23-21)24-8-10-25(11-9-24)30(26,27)20-6-4-19(28-3)5-7-20;1-28-17-2-4-18(5-3-17)30(26,27)25-8-6-24(7-9-25)20-23-19(13-29-20)14-10-15(21)12-16(22)11-14;1-28-15-3-5-16(6-4-15)30(26,27)25-10-8-24(9-11-25)20-23-19(13-29-20)14-2-7-18(22)17(21)12-14;1-28-15-3-5-16(6-4-15)30(26,27)25-10-8-24(9-11-25)20-23-19(13-29-20)14-2-7-17(21)18(22)12-14;1-28-17-2-4-18(5-3-17)30(26,27)25-8-6-24(7-9-25)20-23-19(13-29-20)14-10-15(21)12-16(22)11-14/h5-8,13-15H,9-12H2,1-4H3;4-7,12-15H,8-11H2,1-3H3;2-5,10-13H,6-9H2,1H3;2*2-7,12-13H,8-11H2,1H3;2-5,10-13H,6-9H2,1H3.

What are the key properties of 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole?

4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole has a molecular weight of 2837.57 g/mol, XLogP of 24.30, 33 rotatable bonds, 0 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(3-chloro-4-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3-chloro-5-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(4-chloro-3-fluorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;4-(3,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-1,3-thiazole;2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-1,3-thiazole is sourced from PubChem (CID 173105274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).