sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide

C155H192BBr4Cl5N35NaO19 — CID 160627245

About sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide

sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide (PubChem CID 160627245) has the molecular formula C155H192BBr4Cl5N35NaO19 and a molecular weight of 3380.15 g/mol. Its IUPAC name is sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide.

Molecular Properties

• Compound Name: sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide
• PubChem CID: 160627245
• Molecular Formula: C155H192BBr4Cl5N35NaO19
• Molecular Weight: 3380.15 g/mol
• Exact Mass: 3372.03
• IUPAC Name: sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide
• SMILES: Brc1ccc2cn[nH]c2c1.Brc1ccc2cnn(CCCN3CCOCC3)c2c1.C1COCCN1.CC1(C)OB(c2ccc3cnn(CCCN4CCOCC4)c3c2)OC1(C)C.COC(=O)c1ccc(N)cc1.COC(=O)c1ccc(Nc2cc(-c3ccc4cnn(CCCN5CCOCC5)c4c3)nc(N3CCOCC3)n2)cc1.ClCCCBr.ClCCCn1ncc2ccc(Br)cc21.Clc1cc(-c2ccc3cnn(CCCN4CCOCC4)c3c2)nc(N2CCOCC2)n1.Clc1cc(Cl)nc(N2CCOCC2)n1.O=C(O)c1ccc(Nc2cc(-c3ccc4cnn(CCCN5CCOCC5)c4c3)nc(N3CCOCC3)n2)cc1.[Na+].[OH-]
• InChI: InChI=1S/C30H35N7O4.C29H33N7O4.C22H27ClN6O2.C20H30BN3O3.C14H18BrN3O.C10H10BrClN2.C8H9Cl2N3O.C8H9NO2.C7H5BrN2.C4H9NO.C3H6BrCl.Na.H2O/c1-39-29(38)22-5-7-25(8-6-22)32-28-20-26(33-30(34-28)36-13-17-41-18-14-36)23-3-4-24-21-31-37(27(24)19-23)10-2-9-35-11-15-40-16-12-35;37-28(38)21-4-6-24(7-5-21)31-27-19-25(32-29(33-27)35-12-16-40-17-13-35)22-2-3-23-20-30-36(26(23)18-22)9-1-8-34-10-14-39-15-11-34;23-21-15-19(25-22(26-21)28-8-12-31-13-9-28)17-2-3-18-16-24-29(20(18)14-17)5-1-4-27-6-10-30-11-7-27;1-19(2)20(3,4)27-21(26-19)17-7-6-16-15-22-24(18(16)14-17)9-5-8-23-10-12-25-13-11-23;15-13-3-2-12-11-16-18(14(12)10-13)5-1-4-17-6-8-19-9-7-17;11-9-3-2-8-7-13-14(5-1-4-12)10(8)6-9;9-6-5-7(10)12-8(11-6)13-1-3-14-4-2-13;1-11-8(10)6-2-4-7(9)5-3-6;8-6-2-1-5-4-9-10-7(5)3-6;1-3-6-4-2-5-1;4-2-1-3-5;;/h3-8,19-21H,2,9-18H2,1H3,(H,32,33,34);2-7,18-20H,1,8-17H2,(H,37,38)(H,31,32,33);2-3,14-16H,1,4-13H2;6-7,14-15H,5,8-13H2,1-4H3;2-3,10-11H,1,4-9H2;2-3,6-7H,1,4-5H2;5H,1-4H2;2-5H,9H2,1H3;1-4H,(H,9,10);5H,1-4H2;1-3H2;;1H2/q;;;;;;;;;;;+1;/p-1
• InChIKey: RHLSHKSHOLIUQC-UHFFFAOYSA-M
• XLogP: 21.23
• TPSA: 560.65 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 52
• Rotatable Bonds: 40
• Heavy Atoms: 220
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3380.15
LogP ≤ 5	21.23
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	52

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide?

The IUPAC name of sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide (CID 160627245) is sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide.

What is the SMILES notation for sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide?

The canonical SMILES for sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide is Brc1ccc2cn[nH]c2c1.Brc1ccc2cnn(CCCN3CCOCC3)c2c1.C1COCCN1.CC1(C)OB(c2ccc3cnn(CCCN4CCOCC4)c3c2)OC1(C)C.COC(=O)c1ccc(N)cc1.COC(=O)c1ccc(Nc2cc(-c3ccc4cnn(CCCN5CCOCC5)c4c3)nc(N3CCOCC3)n2)cc1.ClCCCBr.ClCCCn1ncc2ccc(Br)cc21.Clc1cc(-c2ccc3cnn(CCCN4CCOCC4)c3c2)nc(N2CCOCC2)n1.Clc1cc(Cl)nc(N2CCOCC2)n1.O=C(O)c1ccc(Nc2cc(-c3ccc4cnn(CCCN5CCOCC5)c4c3)nc(N3CCOCC3)n2)cc1.[Na+].[OH-].

What is the InChIKey of sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide?

The InChIKey is RHLSHKSHOLIUQC-UHFFFAOYSA-M. The full InChI is InChI=1S/C30H35N7O4.C29H33N7O4.C22H27ClN6O2.C20H30BN3O3.C14H18BrN3O.C10H10BrClN2.C8H9Cl2N3O.C8H9NO2.C7H5BrN2.C4H9NO.C3H6BrCl.Na.H2O/c1-39-29(38)22-5-7-25(8-6-22)32-28-20-26(33-30(34-28)36-13-17-41-18-14-36)23-3-4-24-21-31-37(27(24)19-23)10-2-9-35-11-15-40-16-12-35;37-28(38)21-4-6-24(7-5-21)31-27-19-25(32-29(33-27)35-12-16-40-17-13-35)22-2-3-23-20-30-36(26(23)18-22)9-1-8-34-10-14-39-15-11-34;23-21-15-19(25-22(26-21)28-8-12-31-13-9-28)17-2-3-18-16-24-29(20(18)14-17)5-1-4-27-6-10-30-11-7-27;1-19(2)20(3,4)27-21(26-19)17-7-6-16-15-22-24(18(16)14-17)9-5-8-23-10-12-25-13-11-23;15-13-3-2-12-11-16-18(14(12)10-13)5-1-4-17-6-8-19-9-7-17;11-9-3-2-8-7-13-14(5-1-4-12)10(8)6-9;9-6-5-7(10)12-8(11-6)13-1-3-14-4-2-13;1-11-8(10)6-2-4-7(9)5-3-6;8-6-2-1-5-4-9-10-7(5)3-6;1-3-6-4-2-5-1;4-2-1-3-5;;/h3-8,19-21H,2,9-18H2,1H3,(H,32,33,34);2-7,18-20H,1,8-17H2,(H,37,38)(H,31,32,33);2-3,14-16H,1,4-13H2;6-7,14-15H,5,8-13H2,1-4H3;2-3,10-11H,1,4-9H2;2-3,6-7H,1,4-5H2;5H,1-4H2;2-5H,9H2,1H3;1-4H,(H,9,10);5H,1-4H2;1-3H2;;1H2/q;;;;;;;;;;;+1;/p-1.

What are the key properties of sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide?

sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide has a molecular weight of 3380.15 g/mol, XLogP of 21.23, 40 rotatable bonds, 6 hydrogen bond donors, and 52 hydrogen bond acceptors.

Where does this data come from?

All data for sodium;1-bromo-3-chloropropane;6-bromo-1-(3-chloropropyl)indazole;6-bromo-1H-indazole;4-[3-(6-bromoindazol-1-yl)propyl]morpholine;4-[4-chloro-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-2-yl]morpholine;4-(4,6-dichloropyrimidin-2-yl)morpholine;methyl 4-aminobenzoate;methyl 4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoate;morpholine;4-[[2-morpholin-4-yl-6-[1-(3-morpholin-4-ylpropyl)indazol-6-yl]pyrimidin-4-yl]amino]benzoic acid;4-[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]propyl]morpholine;hydroxide is sourced from PubChem (CID 160627245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).