3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine

C137H149N35O2S6 — CID 160913135

About 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine

3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine (PubChem CID 160913135) has the molecular formula C137H149N35O2S6 and a molecular weight of 2510.34 g/mol. Its IUPAC name is 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

• Compound Name: 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine
• PubChem CID: 160913135
• Molecular Formula: C137H149N35O2S6
• Molecular Weight: 2510.34 g/mol
• Exact Mass: 2508.10
• IUPAC Name: 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine
• SMILES: CCN(CC)c1cc(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c(C)cc1C.CCN(CC)c1ccc(C)c(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c1.CCN(CC)c1ccc(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c(C)c1.COc1ccc(C)c(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c1.Cc1cn(-c2ccc(-c3csc(Nc4cc(N5CCCCC5)ccc4C)n3)cn2)cn1.Cc1cn(-c2ccc(-c3csc(Nc4cc(N5CCOCC5)ccc4C)n3)cn2)cn1
• InChI: InChI=1S/C24H26N6S.C24H28N6S.C23H24N6OS.2C23H26N6S.C20H19N5OS/c1-17-6-8-20(29-10-4-3-5-11-29)12-21(17)27-24-28-22(15-31-24)19-7-9-23(25-13-19)30-14-18(2)26-16-30;1-6-29(7-2)22-11-20(16(3)10-17(22)4)27-24-28-21(14-31-24)19-8-9-23(25-12-19)30-13-18(5)26-15-30;1-16-3-5-19(28-7-9-30-10-8-28)11-20(16)26-23-27-21(14-31-23)18-4-6-22(24-12-18)29-13-17(2)25-15-29;1-5-28(6-2)19-8-9-20(16(3)11-19)26-23-27-21(14-30-23)18-7-10-22(24-12-18)29-13-17(4)25-15-29;1-5-28(6-2)19-9-7-16(3)20(11-19)26-23-27-21(14-30-23)18-8-10-22(24-12-18)29-13-17(4)25-15-29;1-13-4-6-16(26-3)8-17(13)23-20-24-18(11-27-20)15-5-7-19(21-9-15)25-10-14(2)22-12-25/h6-9,12-16H,3-5,10-11H2,1-2H3,(H,27,28);8-15H,6-7H2,1-5H3,(H,27,28);3-6,11-15H,7-10H2,1-2H3,(H,26,27);2*7-15H,5-6H2,1-4H3,(H,26,27);4-12H,1-3H3,(H,23,24)
• InChIKey: SRBBVXCTKBAXSL-UHFFFAOYSA-N
• XLogP: 32.19
• TPSA: 368.44 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 43
• Rotatable Bonds: 36
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2510.34
LogP ≤ 5	32.19
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine?

The IUPAC name of 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine (CID 160913135) is 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine.

What is the SMILES notation for 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine?

The canonical SMILES for 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine is CCN(CC)c1cc(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c(C)cc1C.CCN(CC)c1ccc(C)c(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c1.CCN(CC)c1ccc(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c(C)c1.COc1ccc(C)c(Nc2nc(-c3ccc(-n4cnc(C)c4)nc3)cs2)c1.Cc1cn(-c2ccc(-c3csc(Nc4cc(N5CCCCC5)ccc4C)n3)cn2)cn1.Cc1cn(-c2ccc(-c3csc(Nc4cc(N5CCOCC5)ccc4C)n3)cn2)cn1.

What is the InChIKey of 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine?

The InChIKey is SRBBVXCTKBAXSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6S.C24H28N6S.C23H24N6OS.2C23H26N6S.C20H19N5OS/c1-17-6-8-20(29-10-4-3-5-11-29)12-21(17)27-24-28-22(15-31-24)19-7-9-23(25-13-19)30-14-18(2)26-16-30;1-6-29(7-2)22-11-20(16(3)10-17(22)4)27-24-28-21(14-31-24)19-8-9-23(25-12-19)30-13-18(5)26-15-30;1-16-3-5-19(28-7-9-30-10-8-28)11-20(16)26-23-27-21(14-31-23)18-4-6-22(24-12-18)29-13-17(2)25-15-29;1-5-28(6-2)19-8-9-20(16(3)11-19)26-23-27-21(14-30-23)18-7-10-22(24-12-18)29-13-17(4)25-15-29;1-5-28(6-2)19-9-7-16(3)20(11-19)26-23-27-21(14-30-23)18-8-10-22(24-12-18)29-13-17(4)25-15-29;1-13-4-6-16(26-3)8-17(13)23-20-24-18(11-27-20)15-5-7-19(21-9-15)25-10-14(2)22-12-25/h6-9,12-16H,3-5,10-11H2,1-2H3,(H,27,28);8-15H,6-7H2,1-5H3,(H,27,28);3-6,11-15H,7-10H2,1-2H3,(H,26,27);2*7-15H,5-6H2,1-4H3,(H,26,27);4-12H,1-3H3,(H,23,24).

What are the key properties of 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine?

3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine has a molecular weight of 2510.34 g/mol, XLogP of 32.19, 36 rotatable bonds, 6 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for 3-N,3-N-diethyl-4,6-dimethyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;1-N,1-N-diethyl-4-methyl-3-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,3-diamine;4-N,4-N-diethyl-2-methyl-1-N-[4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]benzene-1,4-diamine;N-(5-methoxy-2-methylphenyl)-4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-morpholin-4-ylphenyl)-1,3-thiazol-2-amine;4-[6-(4-methylimidazol-1-yl)-3-pyridinyl]-N-(2-methyl-5-piperidin-1-ylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 160913135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).