4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one

C130H99F18N15O19 — CID 158530460

About 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one

4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one (PubChem CID 158530460) has the molecular formula C130H99F18N15O19 and a molecular weight of 2517.27 g/mol. Its IUPAC name is 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one.

Molecular Properties

• Compound Name: 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one
• PubChem CID: 158530460
• Molecular Formula: C130H99F18N15O19
• Molecular Weight: 2517.27 g/mol
• Exact Mass: 2515.70
• IUPAC Name: 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one
• SMILES: COC1=C(C(=O)c2ccc(C)cc2)C(c2ccc(C(C)C)cc2)N(c2ccc(C)nn2)C1=O.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(-c4ccccn4)cc3)C2c2ccc(OC(F)(F)F)cc2)nn1.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(C(F)(F)F)cc3)C2c2ccc(C(F)(F)F)cc2)nn1.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(OC(F)(F)F)cc3)C2c2ccc(C(C)C)cc2)cn1.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(OC(F)(F)F)cc3)C2c2ccc(OC(F)(F)F)cc2)nn1
• InChI: InChI=1S/C28H19F3N4O4.C27H23F3N2O4.C27H27N3O3.C24H15F6N3O5.C24H15F6N3O3/c1-16-5-14-22(34-33-16)35-24(18-10-12-20(13-11-18)39-28(29,30)31)23(26(37)27(35)38)25(36)19-8-6-17(7-9-19)21-4-2-3-15-32-21;1-15(2)17-5-7-18(8-6-17)23-22(24(33)19-9-12-21(13-10-19)36-27(28,29)30)25(34)26(35)32(23)20-11-4-16(3)31-14-20;1-16(2)19-11-13-20(14-12-19)24-23(25(31)21-9-6-17(3)7-10-21)26(33-5)27(32)30(24)22-15-8-18(4)28-29-22;1-12-2-11-17(32-31-12)33-19(13-3-7-15(8-4-13)37-23(25,26)27)18(21(35)22(33)36)20(34)14-5-9-16(10-6-14)38-24(28,29)30;1-12-2-11-17(32-31-12)33-19(13-3-7-15(8-4-13)23(25,26)27)18(21(35)22(33)36)20(34)14-5-9-16(10-6-14)24(28,29)30/h2-15,24,36H,1H3;4-15,23,33H,1-3H3;6-16,24H,1-5H3;2-11,19,34H,1H3;2-11,19,34H,1H3
• InChIKey: VICCBEDGFKENEQ-UHFFFAOYSA-N
• XLogP: 27.16
• TPSA: 442.87 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 29
• Rotatable Bonds: 24
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2517.27
LogP ≤ 5	27.16
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one?

The IUPAC name of 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one (CID 158530460) is 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one.

What is the SMILES notation for 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one?

The canonical SMILES for 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one is COC1=C(C(=O)c2ccc(C)cc2)C(c2ccc(C(C)C)cc2)N(c2ccc(C)nn2)C1=O.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(-c4ccccn4)cc3)C2c2ccc(OC(F)(F)F)cc2)nn1.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(C(F)(F)F)cc3)C2c2ccc(C(F)(F)F)cc2)nn1.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(OC(F)(F)F)cc3)C2c2ccc(C(C)C)cc2)cn1.Cc1ccc(N2C(=O)C(=O)C(=C(O)c3ccc(OC(F)(F)F)cc3)C2c2ccc(OC(F)(F)F)cc2)nn1.

What is the InChIKey of 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one?

The InChIKey is VICCBEDGFKENEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H19F3N4O4.C27H23F3N2O4.C27H27N3O3.C24H15F6N3O5.C24H15F6N3O3/c1-16-5-14-22(34-33-16)35-24(18-10-12-20(13-11-18)39-28(29,30)31)23(26(37)27(35)38)25(36)19-8-6-17(7-9-19)21-4-2-3-15-32-21;1-15(2)17-5-7-18(8-6-17)23-22(24(33)19-9-12-21(13-10-19)36-27(28,29)30)25(34)26(35)32(23)20-11-4-16(3)31-14-20;1-16(2)19-11-13-20(14-12-19)24-23(25(31)21-9-6-17(3)7-10-21)26(33-5)27(32)30(24)22-15-8-18(4)28-29-22;1-12-2-11-17(32-31-12)33-19(13-3-7-15(8-4-13)37-23(25,26)27)18(21(35)22(33)36)20(34)14-5-9-16(10-6-14)38-24(28,29)30;1-12-2-11-17(32-31-12)33-19(13-3-7-15(8-4-13)23(25,26)27)18(21(35)22(33)36)20(34)14-5-9-16(10-6-14)24(28,29)30/h2-15,24,36H,1H3;4-15,23,33H,1-3H3;6-16,24H,1-5H3;2-11,19,34H,1H3;2-11,19,34H,1H3.

What are the key properties of 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one?

4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one has a molecular weight of 2517.27 g/mol, XLogP of 27.16, 24 rotatable bonds, 4 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[hydroxy-(4-pyridin-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethoxy)phenyl]methylidene]-1-(6-methyl-3-pyridinyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione;4-[hydroxy-[4-(trifluoromethyl)phenyl]methylidene]-1-(6-methylpyridazin-3-yl)-5-[4-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione;4-methoxy-3-(4-methylbenzoyl)-1-(6-methylpyridazin-3-yl)-2-(4-propan-2-ylphenyl)-2H-pyrrol-5-one is sourced from PubChem (CID 158530460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).