dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide

C96H88Br2ClF4K2N11O30 — CID 163810875

About dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide

dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide (PubChem CID 163810875) has the molecular formula C96H88Br2ClF4K2N11O30 and a molecular weight of 2225.26 g/mol. Its IUPAC name is dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide.

Molecular Properties

• Compound Name: dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide
• PubChem CID: 163810875
• Molecular Formula: C96H88Br2ClF4K2N11O30
• Molecular Weight: 2225.26 g/mol
• Exact Mass: 2221.30
• IUPAC Name: dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide
• SMILES: Br.Br.COc1cc2nccc(Cl)c2c2c1OCCO2.COc1cc2nccc(Oc3ccc([N+](=O)[O-])cc3F)c2c2c1OCCO2.Nc1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c4c(c23)OCCO4)c(F)c1.O=CO[O-].O=[N+]([O-])c1ccc(Oc2ccnc3cc(O)c4c(c23)OCCO4)c(F)c1.O=[N+]([O-])c1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c4c(c23)OCCO4)c(F)c1.[H-].[K+].[K+]
• InChI: InChI=1S/C24H24FN3O7.C24H26FN3O5.C18H13FN2O6.C17H11FN2O6.C12H10ClNO3.CH2O3.2BrH.2K.H/c25-17-14-16(28(29)30)2-3-19(17)35-20-4-5-26-18-15-21(23-24(22(18)20)34-13-12-33-23)32-9-1-6-27-7-10-31-11-8-27;25-17-14-16(26)2-3-19(17)33-20-4-5-27-18-15-21(23-24(22(18)20)32-13-12-31-23)30-9-1-6-28-7-10-29-11-8-28;1-24-15-9-12-16(18-17(15)25-6-7-26-18)14(4-5-20-12)27-13-3-2-10(21(22)23)8-11(13)19;18-10-7-9(20(22)23)1-2-13(10)26-14-3-4-19-11-8-12(21)16-17(15(11)14)25-6-5-24-16;1-15-9-6-8-10(7(13)2-3-14-8)12-11(9)16-4-5-17-12;2-1-4-3;;;;;/h2-5,14-15H,1,6-13H2;2-5,14-15H,1,6-13,26H2;2-5,8-9H,6-7H2,1H3;1-4,7-8,21H,5-6H2;2-3,6H,4-5H2,1H3;1,3H;2*1H;;;/q;;;;;;;;2*+1;-1/p-1
• InChIKey: NRYHZCJYPCFZEB-UHFFFAOYSA-M
• XLogP: 11.35
• TPSA: 480.56 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 38
• Rotatable Bonds: 24
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2225.26
LogP ≤ 5	11.35
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide?

The IUPAC name of dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide (CID 163810875) is dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide.

What is the SMILES notation for dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide?

The canonical SMILES for dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide is Br.Br.COc1cc2nccc(Cl)c2c2c1OCCO2.COc1cc2nccc(Oc3ccc([N+](=O)[O-])cc3F)c2c2c1OCCO2.Nc1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c4c(c23)OCCO4)c(F)c1.O=CO[O-].O=[N+]([O-])c1ccc(Oc2ccnc3cc(O)c4c(c23)OCCO4)c(F)c1.O=[N+]([O-])c1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c4c(c23)OCCO4)c(F)c1.[H-].[K+].[K+].

What is the InChIKey of dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide?

The InChIKey is NRYHZCJYPCFZEB-UHFFFAOYSA-M. The full InChI is InChI=1S/C24H24FN3O7.C24H26FN3O5.C18H13FN2O6.C17H11FN2O6.C12H10ClNO3.CH2O3.2BrH.2K.H/c25-17-14-16(28(29)30)2-3-19(17)35-20-4-5-26-18-15-21(23-24(22(18)20)34-13-12-33-23)32-9-1-6-27-7-10-31-11-8-27;25-17-14-16(26)2-3-19(17)33-20-4-5-27-18-15-21(23-24(22(18)20)32-13-12-31-23)30-9-1-6-28-7-10-29-11-8-28;1-24-15-9-12-16(18-17(15)25-6-7-26-18)14(4-5-20-12)27-13-3-2-10(21(22)23)8-11(13)19;18-10-7-9(20(22)23)1-2-13(10)26-14-3-4-19-11-8-12(21)16-17(15(11)14)25-6-5-24-16;1-15-9-6-8-10(7(13)2-3-14-8)12-11(9)16-4-5-17-12;2-1-4-3;;;;;/h2-5,14-15H,1,6-13H2;2-5,14-15H,1,6-13,26H2;2-5,8-9H,6-7H2,1H3;1-4,7-8,21H,5-6H2;2-3,6H,4-5H2,1H3;1,3H;2*1H;;;/q;;;;;;;;2*+1;-1/p-1.

What are the key properties of dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide?

dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide has a molecular weight of 2225.26 g/mol, XLogP of 11.35, 24 rotatable bonds, 2 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;10-chloro-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;3-fluoro-4-[[5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-10-yl]oxy]aniline;10-(2-fluoro-4-nitrophenoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinolin-5-ol;10-(2-fluoro-4-nitrophenoxy)-5-methoxy-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;10-(2-fluoro-4-nitrophenoxy)-5-(3-morpholin-4-ylpropoxy)-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline;hydride;oxido formate;dihydrobromide is sourced from PubChem (CID 163810875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).