1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole

C141H156F6N20O8S14 — CID 159445015

About 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole

1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole (PubChem CID 159445015) has the molecular formula C141H156F6N20O8S14 and a molecular weight of 2821.86 g/mol. Its IUPAC name is 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole.

Molecular Properties

• Compound Name: 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole
• PubChem CID: 159445015
• Molecular Formula: C141H156F6N20O8S14
• Molecular Weight: 2821.86 g/mol
• Exact Mass: 2818.84
• IUPAC Name: 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole
• SMILES: C.C.C.C.C.C.C=C(N)c1cccc(Cc2nc(-c3sc(C)nc3C)cs2)c1.CC(=O)Nc1nc(C)c(-c2csc(Cc3cc(F)ccc3OC(C)C)n2)s1.CC(C)Oc1ccccc1Cc1nc(-c2cccnc2)cs1.CCc1nc(N)sc1-c1nc(Cc2ccccc2OC)sc1C.COc1ccc(F)cc1Cc1nc(-c2cccnc2)cs1.COc1ccccc1Cc1nc(-c2cnc(N)s2)cs1.Cc1nc(C)c(-c2csc(Cc3cc(F)ccc3OC(C)C)n2)s1.Cc1nc(C)c(-c2csc(Cc3ccccc3OC(F)(F)F)n2)s1
• InChI: InChI=1S/C19H20FN3O2S2.C18H19FN2OS2.C18H18N2OS.C17H19N3OS2.C17H17N3S2.C16H13F3N2OS2.C16H13FN2OS.C14H13N3OS2.6CH4/c1-10(2)25-16-6-5-14(20)7-13(16)8-17-23-15(9-26-17)18-11(3)21-19(27-18)22-12(4)24;1-10(2)22-16-6-5-14(19)7-13(16)8-17-21-15(9-23-17)18-11(3)20-12(4)24-18;1-13(2)21-17-8-4-3-6-14(17)10-18-20-16(12-22-18)15-7-5-9-19-11-15;1-4-12-16(23-17(18)19-12)15-10(2)22-14(20-15)9-11-7-5-6-8-13(11)21-3;1-10(18)14-6-4-5-13(7-14)8-16-20-15(9-21-16)17-11(2)19-12(3)22-17;1-9-15(24-10(2)20-9)12-8-23-14(21-12)7-11-5-3-4-6-13(11)22-16(17,18)19;1-20-15-5-4-13(17)7-12(15)8-16-19-14(10-21-16)11-3-2-6-18-9-11;1-18-11-5-3-2-4-9(11)6-13-17-10(8-19-13)12-7-16-14(15)20-12;;;;;;/h5-7,9-10H,8H2,1-4H3,(H,21,22,24);5-7,9-10H,8H2,1-4H3;3-9,11-13H,10H2,1-2H3;5-8H,4,9H2,1-3H3,(H2,18,19);4-7,9H,1,8,18H2,2-3H3;3-6,8H,7H2,1-2H3;2-7,9-10H,8H2,1H3;2-5,7-8H,6H2,1H3,(H2,15,16);6*1H4
• InChIKey: LSQNZXSUUKHPHW-UHFFFAOYSA-N
• XLogP: 40.34
• TPSA: 378.01 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 41
• Rotatable Bonds: 37
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2821.86
LogP ≤ 5	40.34
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole?

The IUPAC name of 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole (CID 159445015) is 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole.

What is the SMILES notation for 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole?

The canonical SMILES for 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole is C.C.C.C.C.C.C=C(N)c1cccc(Cc2nc(-c3sc(C)nc3C)cs2)c1.CC(=O)Nc1nc(C)c(-c2csc(Cc3cc(F)ccc3OC(C)C)n2)s1.CC(C)Oc1ccccc1Cc1nc(-c2cccnc2)cs1.CCc1nc(N)sc1-c1nc(Cc2ccccc2OC)sc1C.COc1ccc(F)cc1Cc1nc(-c2cccnc2)cs1.COc1ccccc1Cc1nc(-c2cnc(N)s2)cs1.Cc1nc(C)c(-c2csc(Cc3cc(F)ccc3OC(C)C)n2)s1.Cc1nc(C)c(-c2csc(Cc3ccccc3OC(F)(F)F)n2)s1.

What is the InChIKey of 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole?

The InChIKey is LSQNZXSUUKHPHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O2S2.C18H19FN2OS2.C18H18N2OS.C17H19N3OS2.C17H17N3S2.C16H13F3N2OS2.C16H13FN2OS.C14H13N3OS2.6CH4/c1-10(2)25-16-6-5-14(20)7-13(16)8-17-23-15(9-26-17)18-11(3)21-19(27-18)22-12(4)24;1-10(2)22-16-6-5-14(19)7-13(16)8-17-21-15(9-23-17)18-11(3)20-12(4)24-18;1-13(2)21-17-8-4-3-6-14(17)10-18-20-16(12-22-18)15-7-5-9-19-11-15;1-4-12-16(23-17(18)19-12)15-10(2)22-14(20-15)9-11-7-5-6-8-13(11)21-3;1-10(18)14-6-4-5-13(7-14)8-16-20-15(9-21-16)17-11(2)19-12(3)22-17;1-9-15(24-10(2)20-9)12-8-23-14(21-12)7-11-5-3-4-6-13(11)22-16(17,18)19;1-20-15-5-4-13(17)7-12(15)8-16-19-14(10-21-16)11-3-2-6-18-9-11;1-18-11-5-3-2-4-9(11)6-13-17-10(8-19-13)12-7-16-14(15)20-12;;;;;;/h5-7,9-10H,8H2,1-4H3,(H,21,22,24);5-7,9-10H,8H2,1-4H3;3-9,11-13H,10H2,1-2H3;5-8H,4,9H2,1-3H3,(H2,18,19);4-7,9H,1,8,18H2,2-3H3;3-6,8H,7H2,1-2H3;2-7,9-10H,8H2,1H3;2-5,7-8H,6H2,1H3,(H2,15,16);6*1H4.

What are the key properties of 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole?

1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole has a molecular weight of 2821.86 g/mol, XLogP of 40.34, 37 rotatable bonds, 4 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]methyl]phenyl]ethenamine;2,4-dimethyl-5-[2-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-4-yl]-1,3-thiazole;4-ethyl-5-[2-[(2-methoxyphenyl)methyl]-5-methyl-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(5-fluoro-2-methoxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole;5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-2,4-dimethyl-1,3-thiazole;N-[5-[2-[(5-fluoro-2-propan-2-yloxyphenyl)methyl]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;methane;5-[2-[(2-methoxyphenyl)methyl]-1,3-thiazol-4-yl]-1,3-thiazol-2-amine;2-[(2-propan-2-yloxyphenyl)methyl]-4-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 159445015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).