6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one

C90H69F9N18O10 — CID 164956656

About 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one

6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one (PubChem CID 164956656) has the molecular formula C90H69F9N18O10 and a molecular weight of 1733.64 g/mol. Its IUPAC name is 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one.

Molecular Properties

• Compound Name: 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one
• PubChem CID: 164956656
• Molecular Formula: C90H69F9N18O10
• Molecular Weight: 1733.64 g/mol
• Exact Mass: 1732.53
• IUPAC Name: 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one
• SMILES: CCOc1ccc2nn(-c3ccc(C)cc3)c(=O)c(-c3ccc(OC(F)(F)F)nc3)c2n1.CCOc1ccc2nn(-c3ccc(C)cc3)c(=O)c(-c3ccc(OC(F)F)cc3)c2n1.Cn1cc2cc(-n3nc4ccc(OCC(F)F)nc4c(-c4ccccc4)c3=O)ccc2n1.Cn1cc2cc(-n3nc4ccc(OCC(F)F)nc4c(-c4ccncc4)c3=O)ccc2n1
• InChI: InChI=1S/C23H17F2N5O2.C23H19F2N3O3.C22H17F3N4O3.C22H16F2N6O2/c1-29-12-15-11-16(7-8-17(15)27-29)30-23(31)21(14-5-3-2-4-6-14)22-18(28-30)9-10-20(26-22)32-13-19(24)25;1-3-30-19-13-12-18-21(26-19)20(15-6-10-17(11-7-15)31-23(24)25)22(29)28(27-18)16-8-4-14(2)5-9-16;1-3-31-18-11-9-16-20(27-18)19(14-6-10-17(26-12-14)32-22(23,24)25)21(30)29(28-16)15-7-4-13(2)5-8-15;1-29-11-14-10-15(2-3-16(14)27-29)30-22(31)20(13-6-8-25-9-7-13)21-17(28-30)4-5-19(26-21)32-12-18(23)24/h2-12,19H,13H2,1H3;4-13,23H,3H2,1-2H3;4-12H,3H2,1-2H3;2-11,18H,12H2,1H3
• InChIKey: BGNCLGSYLWOOQA-UHFFFAOYSA-N
• XLogP: 16.56
• TPSA: 307.92 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 21
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1733.64
LogP ≤ 5	16.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one?

The IUPAC name of 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one (CID 164956656) is 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one.

What is the SMILES notation for 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one?

The canonical SMILES for 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one is CCOc1ccc2nn(-c3ccc(C)cc3)c(=O)c(-c3ccc(OC(F)(F)F)nc3)c2n1.CCOc1ccc2nn(-c3ccc(C)cc3)c(=O)c(-c3ccc(OC(F)F)cc3)c2n1.Cn1cc2cc(-n3nc4ccc(OCC(F)F)nc4c(-c4ccccc4)c3=O)ccc2n1.Cn1cc2cc(-n3nc4ccc(OCC(F)F)nc4c(-c4ccncc4)c3=O)ccc2n1.

What is the InChIKey of 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one?

The InChIKey is BGNCLGSYLWOOQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17F2N5O2.C23H19F2N3O3.C22H17F3N4O3.C22H16F2N6O2/c1-29-12-15-11-16(7-8-17(15)27-29)30-23(31)21(14-5-3-2-4-6-14)22-18(28-30)9-10-20(26-22)32-13-19(24)25;1-3-30-19-13-12-18-21(26-19)20(15-6-10-17(11-7-15)31-23(24)25)22(29)28(27-18)16-8-4-14(2)5-9-16;1-3-31-18-11-9-16-20(27-18)19(14-6-10-17(26-12-14)32-22(23,24)25)21(30)29(28-16)15-7-4-13(2)5-8-15;1-29-11-14-10-15(2-3-16(14)27-29)30-22(31)20(13-6-8-25-9-7-13)21-17(28-30)4-5-19(26-21)32-12-18(23)24/h2-12,19H,13H2,1H3;4-13,23H,3H2,1-2H3;4-12H,3H2,1-2H3;2-11,18H,12H2,1H3.

What are the key properties of 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one?

6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one has a molecular weight of 1733.64 g/mol, XLogP of 16.56, 21 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one is sourced from PubChem (CID 164956656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).