2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile

C178H131Cl2F27N28O12S10+2 — CID 158036741

About 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile

2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile (PubChem CID 158036741) has the molecular formula C178H131Cl2F27N28O12S10+2 and a molecular weight of 3758.71 g/mol. Its IUPAC name is 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile.

Molecular Properties

• Compound Name: 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile
• PubChem CID: 158036741
• Molecular Formula: C178H131Cl2F27N28O12S10+2
• Molecular Weight: 3758.71 g/mol
• Exact Mass: 3754.66
• IUPAC Name: 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile
• SMILES: CN(CCCC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(-c2cccc(Cl)c2)cs1)CC(=O)O.C[N+]1(C)CCN(C(=O)c2cccc(Cc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2)CC1.C[n+]1cccc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)c1.FC(F)(F)c1cccc(Cc2nc(-c3cncc(Cl)c3)cs2)c1.N#Cc1cc(C(=O)O)cc(-c2csc(Nc3cccc(C(F)(F)F)c3)n2)c1.N#Cc1cccc(-c2csc(Cc3cccc(C(F)(F)F)n3)n2)c1.N#Cc1cncc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)c1.O=[N+]([O-])c1cccc(-c2csc(Cc3cccc(C(F)(F)F)n3)n2)c1.O=c1cc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)cc[nH]1.[O-][n+]1ccccc1-c1csc(Nc2cccc(C(F)(F)F)c2)n1
• InChI: InChI=1S/C23H21ClF3N3O3S.C23H25N4O3S.C18H10F3N3O2S.2C17H10F3N3S.C17H14F3N2S.C16H10ClF3N2S.C16H10F3N3O2S.C16H11F3N2OS.C15H10F3N3OS/c1-29(13-21(32)33)10-4-9-20(31)30(18-8-3-6-16(12-18)23(25,26)27)22-28-19(14-34-22)15-5-2-7-17(24)11-15;1-27(2)11-9-25(10-12-27)23(28)19-7-3-5-17(13-19)14-22-24-21(16-31-22)18-6-4-8-20(15-18)26(29)30;19-18(20,21)13-2-1-3-14(7-13)23-17-24-15(9-27-17)11-4-10(8-22)5-12(6-11)16(25)26;18-17(19,20)15-6-2-5-13(22-15)8-16-23-14(10-24-16)12-4-1-3-11(7-12)9-21;18-17(19,20)14-3-1-2-11(5-14)6-16-23-15(10-24-16)13-4-12(7-21)8-22-9-13;1-22-7-3-5-13(10-22)15-11-23-16(21-15)9-12-4-2-6-14(8-12)17(18,19)20;17-13-6-11(7-21-8-13)14-9-23-15(22-14)5-10-2-1-3-12(4-10)16(18,19)20;17-16(18,19)14-6-2-4-11(20-14)8-15-21-13(9-25-15)10-3-1-5-12(7-10)22(23)24;17-16(18,19)12-3-1-2-10(6-12)7-15-21-13(9-23-15)11-4-5-20-14(22)8-11;16-15(17,18)10-4-3-5-11(8-10)19-14-20-12(9-23-14)13-6-1-2-7-21(13)22/h2-3,5-8,11-12,14H,4,9-10,13H2,1H3,(H,32,33);3-8,13,15-16H,9-12,14H2,1-2H3;1-7,9H,(H,23,24)(H,25,26);1-7,10H,8H2;1-5,8-10H,6H2;2-8,10-11H,9H2,1H3;1-4,6-9H,5H2;1-7,9H,8H2;1-6,8-9H,7H2,(H,20,22);1-9H,(H,19,20)/q;+1;;;;+1
• InChIKey: BYEXSXRLWGYPCZ-UHFFFAOYSA-N
• XLogP: 47.05
• TPSA: 544.31 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 40
• Rotatable Bonds: 40
• Heavy Atoms: 257
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3758.71
LogP ≤ 5	47.05
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile?

The IUPAC name of 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile (CID 158036741) is 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile.

What is the SMILES notation for 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile?

The canonical SMILES for 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile is CN(CCCC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(-c2cccc(Cl)c2)cs1)CC(=O)O.C[N+]1(C)CCN(C(=O)c2cccc(Cc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2)CC1.C[n+]1cccc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)c1.FC(F)(F)c1cccc(Cc2nc(-c3cncc(Cl)c3)cs2)c1.N#Cc1cc(C(=O)O)cc(-c2csc(Nc3cccc(C(F)(F)F)c3)n2)c1.N#Cc1cccc(-c2csc(Cc3cccc(C(F)(F)F)n3)n2)c1.N#Cc1cncc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)c1.O=[N+]([O-])c1cccc(-c2csc(Cc3cccc(C(F)(F)F)n3)n2)c1.O=c1cc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)cc[nH]1.[O-][n+]1ccccc1-c1csc(Nc2cccc(C(F)(F)F)c2)n1.

What is the InChIKey of 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile?

The InChIKey is BYEXSXRLWGYPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClF3N3O3S.C23H25N4O3S.C18H10F3N3O2S.2C17H10F3N3S.C17H14F3N2S.C16H10ClF3N2S.C16H10F3N3O2S.C16H11F3N2OS.C15H10F3N3OS/c1-29(13-21(32)33)10-4-9-20(31)30(18-8-3-6-16(12-18)23(25,26)27)22-28-19(14-34-22)15-5-2-7-17(24)11-15;1-27(2)11-9-25(10-12-27)23(28)19-7-3-5-17(13-19)14-22-24-21(16-31-22)18-6-4-8-20(15-18)26(29)30;19-18(20,21)13-2-1-3-14(7-13)23-17-24-15(9-27-17)11-4-10(8-22)5-12(6-11)16(25)26;18-17(19,20)15-6-2-5-13(22-15)8-16-23-14(10-24-16)12-4-1-3-11(7-12)9-21;18-17(19,20)14-3-1-2-11(5-14)6-16-23-15(10-24-16)13-4-12(7-21)8-22-9-13;1-22-7-3-5-13(10-22)15-11-23-16(21-15)9-12-4-2-6-14(8-12)17(18,19)20;17-13-6-11(7-21-8-13)14-9-23-15(22-14)5-10-2-1-3-12(4-10)16(18,19)20;17-16(18,19)14-6-2-4-11(20-14)8-15-21-13(9-25-15)10-3-1-5-12(7-10)22(23)24;17-16(18,19)12-3-1-2-10(6-12)7-15-21-13(9-23-15)11-4-5-20-14(22)8-11;16-15(17,18)10-4-3-5-11(8-10)19-14-20-12(9-23-14)13-6-1-2-7-21(13)22/h2-3,5-8,11-12,14H,4,9-10,13H2,1H3,(H,32,33);3-8,13,15-16H,9-12,14H2,1-2H3;1-7,9H,(H,23,24)(H,25,26);1-7,10H,8H2;1-5,8-10H,6H2;2-8,10-11H,9H2,1H3;1-4,6-9H,5H2;1-7,9H,8H2;1-6,8-9H,7H2,(H,20,22);1-9H,(H,19,20)/q;+1;;;;+1;;;;.

What are the key properties of 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile?

2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile has a molecular weight of 3758.71 g/mol, XLogP of 47.05, 40 rotatable bonds, 5 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[4-[N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]-3-(trifluoromethyl)anilino]-4-oxobutyl]-methylamino]acetic acid;4-(5-chloro-3-pyridinyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;3-cyano-5-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]benzoic acid;(4,4-dimethylpiperazin-4-ium-1-yl)-[3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]methyl]phenyl]methanone;4-(1-methylpyridin-1-ium-3-yl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;4-(3-nitrophenyl)-2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazole;4-(1-oxidopyridin-1-ium-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine;5-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]pyridine-3-carbonitrile;4-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-4-yl]-1H-pyridin-2-one;3-[2-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1,3-thiazol-4-yl]benzonitrile is sourced from PubChem (CID 158036741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).