2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine

C175H161Cl5F7N21O12S2 — CID 159091836

About 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine

2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine (PubChem CID 159091836) has the molecular formula C175H161Cl5F7N21O12S2 and a molecular weight of 3124.73 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine.

Molecular Properties

• Compound Name: 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine
• PubChem CID: 159091836
• Molecular Formula: C175H161Cl5F7N21O12S2
• Molecular Weight: 3124.73 g/mol
• Exact Mass: 3120.04
• IUPAC Name: 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine
• SMILES: COc1cc(C)nc2ccccc12.COc1ccc2[nH]cc(C)c2c1.COc1cccc2c(C)c[nH]c12.Cc1cc(-c2ccc(Cl)cc2)no1.Cc1cc(-c2ccc(F)cc2)no1.Cc1cc(-c2ccccc2)n[nH]1.Cc1cc(-c2ccccc2)no1.Cc1cc(-c2ccccc2)on1.Cc1cc(-c2ccccc2Cl)no1.Cc1cc2cc(OC(F)(F)F)ccc2[nH]1.Cc1cc2cccnc2nc1C(F)(F)F.Cc1ccc(-c2nc(C)cs2)cc1.Cc1cccc(-c2cc(C)no2)c1.Cc1cn(C)c2ccccc2c1=O.Cc1nc(-c2ccc(Cl)cc2)sc1C.Cc1nc(C)n(-c2ccc(Cl)cc2Cl)n1.Cc1ncoc1-c1ccccc1
• InChI: InChI=1S/C11H10ClNS.3C11H11NO.C11H11NS.C10H9Cl2N3.2C10H8ClNO.C10H7F3N2.C10H8F3NO.C10H8FNO.C10H10N2.2C10H11NO.3C10H9NO/c1-7-8(2)14-11(13-7)9-3-5-10(12)6-4-9;1-8-4-3-5-10(6-8)11-7-9(2)12-13-11;1-8-7-12(2)10-6-4-3-5-9(10)11(8)13;1-8-7-11(13-2)9-5-3-4-6-10(9)12-8;1-8-3-5-10(6-4-8)11-12-9(2)7-13-11;1-6-13-7(2)15(14-6)10-4-3-8(11)5-9(10)12;1-7-6-10(12-13-7)8-2-4-9(11)5-3-8;1-7-6-10(12-13-7)8-4-2-3-5-9(8)11;1-6-5-7-3-2-4-14-9(7)15-8(6)10(11,12)13;1-6-4-7-5-8(15-10(11,12)13)2-3-9(7)14-6;1-7-6-10(12-13-7)8-2-4-9(11)5-3-8;1-8-7-10(12-11-8)9-5-3-2-4-6-9;1-7-6-11-10-4-3-8(12-2)5-9(7)10;1-7-6-11-10-8(7)4-3-5-9(10)12-2;1-8-10(12-7-11-8)9-5-3-2-4-6-9;1-8-7-10(11-12-8)9-5-3-2-4-6-9;1-8-7-10(12-11-8)9-5-3-2-4-6-9/h3-6H,1-2H3;4*3-7H,1-2H3;3-5H,1-2H3;2*2-6H,1H3;2-5H,1H3;2-5,14H,1H3;2-6H,1H3;2-7H,1H3,(H,11,12);2*3-6,11H,1-2H3;3*2-7H,1H3
• InChIKey: KCDXWXCPRDBELS-UHFFFAOYSA-N
• XLogP: 49.09
• TPSA: 412.34 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Rotatable Bonds: 15
• Heavy Atoms: 222
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3124.73
LogP ≤ 5	49.09
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine?

The IUPAC name of 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine (CID 159091836) is 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine.

What is the SMILES notation for 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine?

The canonical SMILES for 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine is COc1cc(C)nc2ccccc12.COc1ccc2[nH]cc(C)c2c1.COc1cccc2c(C)c[nH]c12.Cc1cc(-c2ccc(Cl)cc2)no1.Cc1cc(-c2ccc(F)cc2)no1.Cc1cc(-c2ccccc2)n[nH]1.Cc1cc(-c2ccccc2)no1.Cc1cc(-c2ccccc2)on1.Cc1cc(-c2ccccc2Cl)no1.Cc1cc2cc(OC(F)(F)F)ccc2[nH]1.Cc1cc2cccnc2nc1C(F)(F)F.Cc1ccc(-c2nc(C)cs2)cc1.Cc1cccc(-c2cc(C)no2)c1.Cc1cn(C)c2ccccc2c1=O.Cc1nc(-c2ccc(Cl)cc2)sc1C.Cc1nc(C)n(-c2ccc(Cl)cc2Cl)n1.Cc1ncoc1-c1ccccc1.

What is the InChIKey of 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine?

The InChIKey is KCDXWXCPRDBELS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNS.3C11H11NO.C11H11NS.C10H9Cl2N3.2C10H8ClNO.C10H7F3N2.C10H8F3NO.C10H8FNO.C10H10N2.2C10H11NO.3C10H9NO/c1-7-8(2)14-11(13-7)9-3-5-10(12)6-4-9;1-8-4-3-5-10(6-8)11-7-9(2)12-13-11;1-8-7-12(2)10-6-4-3-5-9(10)11(8)13;1-8-7-11(13-2)9-5-3-4-6-10(9)12-8;1-8-3-5-10(6-4-8)11-12-9(2)7-13-11;1-6-13-7(2)15(14-6)10-4-3-8(11)5-9(10)12;1-7-6-10(12-13-7)8-2-4-9(11)5-3-8;1-7-6-10(12-13-7)8-4-2-3-5-9(8)11;1-6-5-7-3-2-4-14-9(7)15-8(6)10(11,12)13;1-6-4-7-5-8(15-10(11,12)13)2-3-9(7)14-6;1-7-6-10(12-13-7)8-2-4-9(11)5-3-8;1-8-7-10(12-11-8)9-5-3-2-4-6-9;1-7-6-11-10-4-3-8(12-2)5-9(7)10;1-7-6-11-10-8(7)4-3-5-9(10)12-2;1-8-10(12-7-11-8)9-5-3-2-4-6-9;1-8-7-10(11-12-8)9-5-3-2-4-6-9;1-8-7-10(12-11-8)9-5-3-2-4-6-9/h3-6H,1-2H3;4*3-7H,1-2H3;3-5H,1-2H3;2*2-6H,1H3;2-5H,1H3;2-5,14H,1H3;2-6H,1H3;2-7H,1H3,(H,11,12);2*3-6,11H,1-2H3;3*2-7H,1H3.

What are the key properties of 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine?

2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine has a molecular weight of 3124.73 g/mol, XLogP of 49.09, 15 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-chlorophenyl)-4,5-dimethyl-1,3-thiazole;3-(2-chlorophenyl)-5-methyl-1,2-oxazole;3-(4-chlorophenyl)-5-methyl-1,2-oxazole;1-(2,4-dichlorophenyl)-3,5-dimethyl-1,2,4-triazole;1,3-dimethylquinolin-4-one;3-(4-fluorophenyl)-5-methyl-1,2-oxazole;5-methoxy-3-methyl-1H-indole;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;3-methyl-5-(3-methylphenyl)-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenyl-1,2-oxazole;4-methyl-5-phenyl-1,3-oxazole;5-methyl-3-phenyl-1,2-oxazole;5-methyl-3-phenyl-1H-pyrazole;2-methyl-5-(trifluoromethoxy)-1H-indole;3-methyl-2-(trifluoromethyl)-1,8-naphthyridine is sourced from PubChem (CID 159091836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).