4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine

C95H75Cl5N20O — CID 157337630

About 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine

4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine (PubChem CID 157337630) has the molecular formula C95H75Cl5N20O and a molecular weight of 1690.05 g/mol. Its IUPAC name is 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine.

Molecular Properties

• Compound Name: 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine
• PubChem CID: 157337630
• Molecular Formula: C95H75Cl5N20O
• Molecular Weight: 1690.05 g/mol
• Exact Mass: 1686.49
• IUPAC Name: 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine
• SMILES: CCn1nc(-c2ccccc2)c2c(Cl)c(-c3ccccc3)nnc21.COc1cccc(-c2nn(C)c3nnc(-c4ccccc4)c(Cl)c23)c1.Cc1cccc(-c2nn(C)c3nnc(-c4ccccc4)c(Cl)c23)c1.Cc1cccc(-c2nnc3c(c(-c4ccccc4)nn3C)c2Cl)c1.Cc1ccccc1-c1nn(C)c2nnc(-c3ccccc3)c(Cl)c12
• InChI: InChI=1S/C19H15ClN4O.4C19H15ClN4/c1-24-19-15(17(23-24)13-9-6-10-14(11-13)25-2)16(20)18(21-22-19)12-7-4-3-5-8-12;1-12-8-6-7-11-14(12)18-15-16(20)17(13-9-4-3-5-10-13)21-22-19(15)24(2)23-18;1-12-7-6-10-14(11-12)17-15-16(20)18(13-8-4-3-5-9-13)21-22-19(15)24(2)23-17;1-12-7-6-10-14(11-12)18-16(20)15-17(13-8-4-3-5-9-13)23-24(2)19(15)22-21-18;1-2-24-19-15(17(23-24)13-9-5-3-6-10-13)16(20)18(21-22-19)14-11-7-4-8-12-14/h3-11H,1-2H3;3*3-11H,1-2H3;3-12H,2H2,1H3
• InChIKey: BGADVRRSAHSLPN-UHFFFAOYSA-N
• XLogP: 23.17
• TPSA: 227.23 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 12
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1690.05
LogP ≤ 5	23.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine?

The IUPAC name of 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine (CID 157337630) is 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine.

What is the SMILES notation for 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine?

The canonical SMILES for 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine is CCn1nc(-c2ccccc2)c2c(Cl)c(-c3ccccc3)nnc21.COc1cccc(-c2nn(C)c3nnc(-c4ccccc4)c(Cl)c23)c1.Cc1cccc(-c2nn(C)c3nnc(-c4ccccc4)c(Cl)c23)c1.Cc1cccc(-c2nnc3c(c(-c4ccccc4)nn3C)c2Cl)c1.Cc1ccccc1-c1nn(C)c2nnc(-c3ccccc3)c(Cl)c12.

What is the InChIKey of 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine?

The InChIKey is BGADVRRSAHSLPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN4O.4C19H15ClN4/c1-24-19-15(17(23-24)13-9-6-10-14(11-13)25-2)16(20)18(21-22-19)12-7-4-3-5-8-12;1-12-8-6-7-11-14(12)18-15-16(20)17(13-9-4-3-5-10-13)21-22-19(15)24(2)23-18;1-12-7-6-10-14(11-12)17-15-16(20)18(13-8-4-3-5-9-13)21-22-19(15)24(2)23-17;1-12-7-6-10-14(11-12)18-16(20)15-17(13-8-4-3-5-9-13)23-24(2)19(15)22-21-18;1-2-24-19-15(17(23-24)13-9-5-3-6-10-13)16(20)18(21-22-19)14-11-7-4-8-12-14/h3-11H,1-2H3;3*3-11H,1-2H3;3-12H,2H2,1H3.

What are the key properties of 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine?

4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine has a molecular weight of 1690.05 g/mol, XLogP of 23.17, 12 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-1-ethyl-3,5-diphenylpyrazolo[3,4-c]pyridazine;4-chloro-3-(3-methoxyphenyl)-1-methyl-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(2-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-3-(3-methylphenyl)-5-phenylpyrazolo[3,4-c]pyridazine;4-chloro-1-methyl-5-(3-methylphenyl)-3-phenylpyrazolo[3,4-c]pyridazine is sourced from PubChem (CID 157337630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).