1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one

C167H139Cl6F19N8O20 — CID 158857410

About 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one

1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one (PubChem CID 158857410) has the molecular formula C167H139Cl6F19N8O20 and a molecular weight of 3151.66 g/mol. Its IUPAC name is 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one.

Molecular Properties

• Compound Name: 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one
• PubChem CID: 158857410
• Molecular Formula: C167H139Cl6F19N8O20
• Molecular Weight: 3151.66 g/mol
• Exact Mass: 3146.79
• IUPAC Name: 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one
• SMILES: C=C(O)c1ccc(CC(=O)C(CC2CCC(=O)CC2)c2ccc(-c3c(OC(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2(C#N)CC2)c2ccc(-c3c(C(F)(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2(C#N)CC2)c2ccc(-c3c(C(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2CC2)c2ccc(-c3c(C(F)(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2CC2)c2ccc(-c3cc(Cl)ccc3C(F)(F)F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2CC2)c2ccc(-c3cc(Cl)ccc3C(F)F)c[n+]2[O-])cc1
• InChI: InChI=1S/C30H27ClF3NO5.C28H21ClF4N2O3.C28H22ClF3N2O3.C27H22ClF4NO3.C27H23ClF3NO3.C27H24ClF2NO3/c1-17(36)20-6-2-19(3-7-20)15-26(38)23(14-18-4-9-22(37)10-5-18)25-12-8-21(16-35(25)39)28-27(40-30(33)34)13-11-24(31)29(28)32;1-16(36)18-4-2-17(3-5-18)12-24(37)20(13-27(15-34)10-11-27)23-9-6-19(14-35(23)38)25-21(28(31,32)33)7-8-22(29)26(25)30;1-16(35)18-4-2-17(3-5-18)12-24(36)21(13-28(15-33)10-11-28)23-9-6-19(14-34(23)37)25-20(27(31)32)7-8-22(29)26(25)30;1-15(34)18-6-4-17(5-7-18)13-24(35)20(12-16-2-3-16)23-11-8-19(14-33(23)36)25-21(27(30,31)32)9-10-22(28)26(25)29;1-16(33)19-6-4-18(5-7-19)13-26(34)23(12-17-2-3-17)25-11-8-20(15-32(25)35)22-14-21(28)9-10-24(22)27(29,30)31;1-16(32)19-6-4-18(5-7-19)13-26(33)24(12-17-2-3-17)25-11-8-20(15-31(25)34)23-14-21(28)9-10-22(23)27(29)30/h2-3,6-8,11-13,16,18,23,30,36H,1,4-5,9-10,14-15H2;2-9,14,20H,10-13H2,1H3;2-9,14,21,27H,10-13H2,1H3;4-11,14,16,20H,2-3,12-13H2,1H3;4-11,14-15,17,23H,2-3,12-13H2,1H3;4-11,14-15,17,24,27H,2-3,12-13H2,1H3
• InChIKey: JAFORNLCZFULPH-UHFFFAOYSA-N
• XLogP: 39.78
• TPSA: 443.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 22
• Rotatable Bonds: 52
• Heavy Atoms: 220
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3151.66
LogP ≤ 5	39.78
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one?

The IUPAC name of 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one (CID 158857410) is 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one.

What is the SMILES notation for 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one?

The canonical SMILES for 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one is C=C(O)c1ccc(CC(=O)C(CC2CCC(=O)CC2)c2ccc(-c3c(OC(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2(C#N)CC2)c2ccc(-c3c(C(F)(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2(C#N)CC2)c2ccc(-c3c(C(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2CC2)c2ccc(-c3c(C(F)(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2CC2)c2ccc(-c3cc(Cl)ccc3C(F)(F)F)c[n+]2[O-])cc1.CC(=O)c1ccc(CC(=O)C(CC2CC2)c2ccc(-c3cc(Cl)ccc3C(F)F)c[n+]2[O-])cc1.

What is the InChIKey of 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one?

The InChIKey is JAFORNLCZFULPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27ClF3NO5.C28H21ClF4N2O3.C28H22ClF3N2O3.C27H22ClF4NO3.C27H23ClF3NO3.C27H24ClF2NO3/c1-17(36)20-6-2-19(3-7-20)15-26(38)23(14-18-4-9-22(37)10-5-18)25-12-8-21(16-35(25)39)28-27(40-30(33)34)13-11-24(31)29(28)32;1-16(36)18-4-2-17(3-5-18)12-24(37)20(13-27(15-34)10-11-27)23-9-6-19(14-35(23)38)25-21(28(31,32)33)7-8-22(29)26(25)30;1-16(35)18-4-2-17(3-5-18)12-24(36)21(13-28(15-33)10-11-28)23-9-6-19(14-34(23)37)25-20(27(31)32)7-8-22(29)26(25)30;1-15(34)18-6-4-17(5-7-18)13-24(35)20(12-16-2-3-16)23-11-8-19(14-33(23)36)25-21(27(30,31)32)9-10-22(28)26(25)29;1-16(33)19-6-4-18(5-7-19)13-26(34)23(12-17-2-3-17)25-11-8-20(15-32(25)35)22-14-21(28)9-10-24(22)27(29,30)31;1-16(32)19-6-4-18(5-7-19)13-26(33)24(12-17-2-3-17)25-11-8-20(15-31(25)34)23-14-21(28)9-10-22(23)27(29)30/h2-3,6-8,11-13,16,18,23,30,36H,1,4-5,9-10,14-15H2;2-9,14,20H,10-13H2,1H3;2-9,14,21,27H,10-13H2,1H3;4-11,14,16,20H,2-3,12-13H2,1H3;4-11,14-15,17,23H,2-3,12-13H2,1H3;4-11,14-15,17,24,27H,2-3,12-13H2,1H3.

What are the key properties of 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one?

1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one has a molecular weight of 3151.66 g/mol, XLogP of 39.78, 52 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-(4-acetylphenyl)-2-[5-[3-chloro-6-(difluoromethyl)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(difluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-(4-acetylphenyl)-3-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;1-[4-(4-acetylphenyl)-2-[5-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-3-oxobutyl]cyclopropane-1-carbonitrile;1-(4-acetylphenyl)-3-[5-[5-chloro-2-(trifluoromethyl)phenyl]-1-oxidopyridin-1-ium-2-yl]-4-cyclopropylbutan-2-one;4-[2-[5-[3-chloro-6-(difluoromethoxy)-2-fluorophenyl]-1-oxidopyridin-1-ium-2-yl]-4-[4-(1-hydroxyethenyl)phenyl]-3-oxobutyl]cyclohexan-1-one is sourced from PubChem (CID 158857410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).