2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane

C122H103Cl6FN24O6 — CID 159465531

About 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane

2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane (PubChem CID 159465531) has the molecular formula C122H103Cl6FN24O6 and a molecular weight of 2233.04 g/mol. Its IUPAC name is 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane.

Molecular Properties

• Compound Name: 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane
• PubChem CID: 159465531
• Molecular Formula: C122H103Cl6FN24O6
• Molecular Weight: 2233.04 g/mol
• Exact Mass: 2228.66
• IUPAC Name: 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane
• SMILES: C.CC(CO)n1nc(-c2ccccc2)c2c(Cl)c(-c3ccccc3)nnc21.COCCn1nc(-c2ccccc2)c2c(Cl)c(-c3ccccc3)nnc21.Cc1cc(F)cc(-c2nn(CCO)c3nnc(-c4ccccc4)c(Cl)c23)c1.Cc1cccc(-c2nn(CCO)c3nnc(-c4ccccc4)c(Cl)c23)c1.Clc1c(-c2ccccc2)nnc2c1c(-c1ccccc1)nn2C1CCOC1.Clc1c(-c2ccccc2)nnc2c1c(-c1ccccc1)nn2C1COC1
• InChI: InChI=1S/C21H17ClN4O.C20H16ClFN4O.C20H15ClN4O.3C20H17ClN4O.CH4/c22-18-17-19(14-7-3-1-4-8-14)25-26(16-11-12-27-13-16)21(17)24-23-20(18)15-9-5-2-6-10-15;1-12-9-14(11-15(22)10-12)18-16-17(21)19(13-5-3-2-4-6-13)23-24-20(16)26(25-18)7-8-27;21-17-16-18(13-7-3-1-4-8-13)24-25(15-11-26-12-15)20(16)23-22-19(17)14-9-5-2-6-10-14;1-26-13-12-25-20-16(18(24-25)14-8-4-2-5-9-14)17(21)19(22-23-20)15-10-6-3-7-11-15;1-13(12-26)25-20-16(18(24-25)14-8-4-2-5-9-14)17(21)19(22-23-20)15-10-6-3-7-11-15;1-13-6-5-9-15(12-13)18-16-17(21)19(14-7-3-2-4-8-14)22-23-20(16)25(24-18)10-11-26;/h1-10,16H,11-13H2;2-6,9-11,27H,7-8H2,1H3;1-10,15H,11-12H2;2-11H,12-13H2,1H3;2-11,13,26H,12H2,1H3;2-9,12,26H,10-11H2,1H3;1H4
• InChIKey: LVCZHHSWTQDFIH-UHFFFAOYSA-N
• XLogP: 26.99
• TPSA: 349.98 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 30
• Rotatable Bonds: 23
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2233.04
LogP ≤ 5	26.99
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane?

The IUPAC name of 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane (CID 159465531) is 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane.

What is the SMILES notation for 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane?

The canonical SMILES for 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane is C.CC(CO)n1nc(-c2ccccc2)c2c(Cl)c(-c3ccccc3)nnc21.COCCn1nc(-c2ccccc2)c2c(Cl)c(-c3ccccc3)nnc21.Cc1cc(F)cc(-c2nn(CCO)c3nnc(-c4ccccc4)c(Cl)c23)c1.Cc1cccc(-c2nn(CCO)c3nnc(-c4ccccc4)c(Cl)c23)c1.Clc1c(-c2ccccc2)nnc2c1c(-c1ccccc1)nn2C1CCOC1.Clc1c(-c2ccccc2)nnc2c1c(-c1ccccc1)nn2C1COC1.

What is the InChIKey of 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane?

The InChIKey is LVCZHHSWTQDFIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN4O.C20H16ClFN4O.C20H15ClN4O.3C20H17ClN4O.CH4/c22-18-17-19(14-7-3-1-4-8-14)25-26(16-11-12-27-13-16)21(17)24-23-20(18)15-9-5-2-6-10-15;1-12-9-14(11-15(22)10-12)18-16-17(21)19(13-5-3-2-4-6-13)23-24-20(16)26(25-18)7-8-27;21-17-16-18(13-7-3-1-4-8-13)24-25(15-11-26-12-15)20(16)23-22-19(17)14-9-5-2-6-10-14;1-26-13-12-25-20-16(18(24-25)14-8-4-2-5-9-14)17(21)19(22-23-20)15-10-6-3-7-11-15;1-13(12-26)25-20-16(18(24-25)14-8-4-2-5-9-14)17(21)19(22-23-20)15-10-6-3-7-11-15;1-13-6-5-9-15(12-13)18-16-17(21)19(14-7-3-2-4-8-14)22-23-20(16)25(24-18)10-11-26;/h1-10,16H,11-13H2;2-6,9-11,27H,7-8H2,1H3;1-10,15H,11-12H2;2-11H,12-13H2,1H3;2-11,13,26H,12H2,1H3;2-9,12,26H,10-11H2,1H3;1H4.

What are the key properties of 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane?

2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane has a molecular weight of 2233.04 g/mol, XLogP of 26.99, 23 rotatable bonds, 3 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-chloro-3,5-diphenylpyrazolo[3,4-c]pyridazin-1-yl)propan-1-ol;2-[4-chloro-3-(3-fluoro-5-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(2-methoxyethyl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;2-[4-chloro-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazin-1-yl]ethanol;4-chloro-1-(oxetan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-1-(oxolan-3-yl)-3,5-diphenylpyrazolo[3,4-c]pyridazine;methane is sourced from PubChem (CID 159465531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).