4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide

C129H145Cl6F7N36O40S5 — CID 159701335

About 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide

4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide (PubChem CID 159701335) has the molecular formula C129H145Cl6F7N36O40S5 and a molecular weight of 3345.83 g/mol. Its IUPAC name is 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide.

Molecular Properties

• Compound Name: 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide
• PubChem CID: 159701335
• Molecular Formula: C129H145Cl6F7N36O40S5
• Molecular Weight: 3345.83 g/mol
• Exact Mass: 3340.70
• IUPAC Name: 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide
• SMILES: C=S(C)(=O)CC(=O)NCCOc1nonc1C(Cc1ccc(F)c(Cl)c1)=NO.C=S(N)(=O)CC(=O)N(C)CCOc1nonc1C(Cc1ccc(F)c(Cl)c1)=NO.C=S(N)(=O)CC(=O)NCCOc1nonc1C(Cc1ccc(F)c(C)c1)=NO.C=S(N)(=O)CC(=O)NCCOc1nonc1C(Cc1ccc(F)c(Cl)c1)=NO.C=S(N)(=O)CC(=O)NCCOc1nonc1C(Cc1cccc(C)c1)=NO.CC(=O)C1(C(=O)CCCOc2nonc2/C(=N/c2ccc(F)c(Cl)c2)NO)CC1.CC(=O)CC(=O)CCCOc1nonc1/C(=N/c1ccc(F)c(Cl)c1)NO.CC(=O)CC(=O)CCCOc1nonc1/C(=N/c1ccc(F)c(Cl)c1)NO
• InChI: InChI=1S/C18H18ClFN4O5.C16H19ClFN5O5S.C16H18ClFN4O5S.2C16H16ClFN4O5.C16H20FN5O5S.C16H21N5O5S.C15H17ClFN5O5S/c1-10(25)18(6-7-18)14(26)3-2-8-28-17-15(23-29-24-17)16(22-27)21-11-4-5-13(20)12(19)9-11;1-23(14(24)9-29(2,19)26)5-6-27-16-15(21-28-22-16)13(20-25)8-10-3-4-12(18)11(17)7-10;1-28(2,25)9-14(23)19-5-6-26-16-15(21-27-22-16)13(20-24)8-10-3-4-12(18)11(17)7-10;2*1-9(23)7-11(24)3-2-6-26-16-14(21-27-22-16)15(20-25)19-10-4-5-13(18)12(17)8-10;1-10-7-11(3-4-12(10)17)8-13(20-24)15-16(22-27-21-15)26-6-5-19-14(23)9-28(2,18)25;1-11-4-3-5-12(8-11)9-13(19-23)15-16(21-26-20-15)25-7-6-18-14(22)10-27(2,17)24;1-28(18,25)8-13(23)19-4-5-26-15-14(21-27-22-15)12(20-24)7-9-2-3-11(17)10(16)6-9/h4-5,9,27H,2-3,6-8H2,1H3,(H,21,22);3-4,7,25H,2,5-6,8-9H2,1H3,(H2,19,26);3-4,7,24H,1,5-6,8-9H2,2H3,(H,19,23);2*4-5,8,25H,2-3,6-7H2,1H3,(H,19,20);3-4,7,24H,2,5-6,8-9H2,1H3,(H2,18,25)(H,19,23);3-5,8,23H,2,6-7,9-10H2,1H3,(H2,17,24)(H,18,22);2-3,6,24H,1,4-5,7-8H2,(H2,18,25)(H,19,23)
• InChIKey: MXQSYWACSOAGNU-UHFFFAOYSA-N
• XLogP: 10.38
• TPSA: 1110.57 Ų
• H-Bond Donors: 19
• H-Bond Acceptors: 64
• Rotatable Bonds: 72
• Heavy Atoms: 223
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3345.83
LogP ≤ 5	10.38
H-Bond Donors ≤ 5	19
H-Bond Acceptors ≤ 10	64

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide?

The IUPAC name of 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide (CID 159701335) is 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide.

What is the SMILES notation for 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide?

The canonical SMILES for 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide is C=S(C)(=O)CC(=O)NCCOc1nonc1C(Cc1ccc(F)c(Cl)c1)=NO.C=S(N)(=O)CC(=O)N(C)CCOc1nonc1C(Cc1ccc(F)c(Cl)c1)=NO.C=S(N)(=O)CC(=O)NCCOc1nonc1C(Cc1ccc(F)c(C)c1)=NO.C=S(N)(=O)CC(=O)NCCOc1nonc1C(Cc1ccc(F)c(Cl)c1)=NO.C=S(N)(=O)CC(=O)NCCOc1nonc1C(Cc1cccc(C)c1)=NO.CC(=O)C1(C(=O)CCCOc2nonc2/C(=N/c2ccc(F)c(Cl)c2)NO)CC1.CC(=O)CC(=O)CCCOc1nonc1/C(=N/c1ccc(F)c(Cl)c1)NO.CC(=O)CC(=O)CCCOc1nonc1/C(=N/c1ccc(F)c(Cl)c1)NO.

What is the InChIKey of 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide?

The InChIKey is MXQSYWACSOAGNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClFN4O5.C16H19ClFN5O5S.C16H18ClFN4O5S.2C16H16ClFN4O5.C16H20FN5O5S.C16H21N5O5S.C15H17ClFN5O5S/c1-10(25)18(6-7-18)14(26)3-2-8-28-17-15(23-29-24-17)16(22-27)21-11-4-5-13(20)12(19)9-11;1-23(14(24)9-29(2,19)26)5-6-27-16-15(21-28-22-16)13(20-25)8-10-3-4-12(18)11(17)7-10;1-28(2,25)9-14(23)19-5-6-26-16-15(21-27-22-16)13(20-24)8-10-3-4-12(18)11(17)7-10;2*1-9(23)7-11(24)3-2-6-26-16-14(21-27-22-16)15(20-25)19-10-4-5-13(18)12(17)8-10;1-10-7-11(3-4-12(10)17)8-13(20-24)15-16(22-27-21-15)26-6-5-19-14(23)9-28(2,18)25;1-11-4-3-5-12(8-11)9-13(19-23)15-16(21-26-20-15)25-7-6-18-14(22)10-27(2,17)24;1-28(18,25)8-13(23)19-4-5-26-15-14(21-27-22-15)12(20-24)7-9-2-3-11(17)10(16)6-9/h4-5,9,27H,2-3,6-8H2,1H3,(H,21,22);3-4,7,25H,2,5-6,8-9H2,1H3,(H2,19,26);3-4,7,24H,1,5-6,8-9H2,2H3,(H,19,23);2*4-5,8,25H,2-3,6-7H2,1H3,(H,19,20);3-4,7,24H,2,5-6,8-9H2,1H3,(H2,18,25)(H,19,23);3-5,8,23H,2,6-7,9-10H2,1H3,(H2,17,24)(H,18,22);2-3,6,24H,1,4-5,7-8H2,(H2,18,25)(H,19,23).

What are the key properties of 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide?

4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide has a molecular weight of 3345.83 g/mol, XLogP of 10.38, 72 rotatable bonds, 19 hydrogen bond donors, and 64 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-(1-acetylcyclopropyl)-4-oxobutoxy]-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-N-methylacetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[C-[(4-fluoro-3-methylphenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;2-(amino-methylidene-oxo-λ6-sulfanyl)-N-[2-[[4-[N-hydroxy-C-[(3-methylphenyl)methyl]carbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]acetamide;bis(N'-(3-chloro-4-fluorophenyl)-4-(4,6-dioxoheptoxy)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide);N-[2-[[4-[C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]oxy]ethyl]-2-(methyl-methylidene-oxo-λ6-sulfanyl)acetamide is sourced from PubChem (CID 159701335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).