lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide

C130H144BrCl2F2LiN51NaO19 — CID 159323208

IUPAClithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide
SMILESCC(C)(C)OC(=O)Nc1cc(C2CC2)cn2cc(Cn3cc(C(=O)OC(C)(C)C)nn3)nc12.CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(Br)c3n2)nn1.CC(C)(C)OC(N)=O.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnc4)c3n2)nn1.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N)c3n2)nn1.COC(OC)OC.NCc1ncn2ccc(Cl)c(F)c12.O=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnn4)c3n2)nn1.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnc4)c3n2)nn1.[Li+].[N-]=[N+]=[N-].[Na+].[OH-]
InChIInChI=1S/C24H19ClFN11O.C23H30N6O4.C18H20BrN5O2.C17H16N8O2.C16H14N8O2.C15H16N6O2.C8H7ClFN3.C5H11NO2.C4H10O3.Li.N3.Na.H2O/c25-17-5-6-34-12-27-18(23(34)22(17)26)3-4-21(38)19-11-36(32-30-19)10-16-9-35-8-15(14-1-2-14)7-20(24(35)29-16)37-13-28-31-33-37;1-22(2,3)32-20(30)18-13-29(27-26-18)12-16-11-28-10-15(14-7-8-14)9-17(19(28)24-16)25-21(31)33-23(4,5)6;1-18(2,3)26-17(25)15-10-24(22-21-15)9-13-8-23-7-12(11-4-5-11)6-14(19)16(23)20-13;1-27-17(26)14-8-25(22-21-14)7-13-6-23-5-12(11-2-3-11)4-15(16(23)20-13)24-9-18-19-10-24;25-16(26)13-7-24(21-20-13)6-12-5-22-4-11(10-1-2-10)3-14(15(22)19-12)23-8-17-18-9-23;1-23-15(22)13-8-21(19-18-13)7-11-6-20-5-10(9-2-3-9)4-12(16)14(20)17-11;9-5-1-2-13-4-12-6(3-11)8(13)7(5)10;1-5(2,3)8-4(6)7;1-5-4(6-2)7-3;;1-3-2;;/h5-9,11-14H,1-4,10H2;9-11,13-14H,7-8,12H2,1-6H3,(H,25,31);6-8,10-11H,4-5,9H2,1-3H3;4-6,8-11H,2-3,7H2,1H3;3-5,7-10H,1-2,6H2,(H,25,26);4-6,8-9H,2-3,7,16H2,1H3;1-2,4H,3,11H2;1-3H3,(H2,6,7);4H,1-3H3;;;;1H2/q;;;;;;;;;+1;-1;+1;/p-1
InChIKeyYFSPHJAUKRQCPT-UHFFFAOYSA-M
MW2943.66 g/mol
LogP11.75
Rot. Bonds35

About lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide

lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide (PubChem CID 159323208) has the molecular formula C130H144BrCl2F2LiN51NaO19 and a molecular weight of 2943.66 g/mol. Its IUPAC name is lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide.

Molecular Properties

Compound Namelithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide
PubChem CID159323208
Molecular FormulaC130H144BrCl2F2LiN51NaO19
Molecular Weight2943.66 g/mol
Exact Mass2940.05
IUPAC Namelithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide
SMILESCC(C)(C)OC(=O)Nc1cc(C2CC2)cn2cc(Cn3cc(C(=O)OC(C)(C)C)nn3)nc12.CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(Br)c3n2)nn1.CC(C)(C)OC(N)=O.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnc4)c3n2)nn1.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N)c3n2)nn1.COC(OC)OC.NCc1ncn2ccc(Cl)c(F)c12.O=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnn4)c3n2)nn1.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnc4)c3n2)nn1.[Li+].[N-]=[N+]=[N-].[Na+].[OH-]
InChIInChI=1S/C24H19ClFN11O.C23H30N6O4.C18H20BrN5O2.C17H16N8O2.C16H14N8O2.C15H16N6O2.C8H7ClFN3.C5H11NO2.C4H10O3.Li.N3.Na.H2O/c25-17-5-6-34-12-27-18(23(34)22(17)26)3-4-21(38)19-11-36(32-30-19)10-16-9-35-8-15(14-1-2-14)7-20(24(35)29-16)37-13-28-31-33-37;1-22(2,3)32-20(30)18-13-29(27-26-18)12-16-11-28-10-15(14-7-8-14)9-17(19(28)24-16)25-21(31)33-23(4,5)6;1-18(2,3)26-17(25)15-10-24(22-21-15)9-13-8-23-7-12(11-4-5-11)6-14(19)16(23)20-13;1-27-17(26)14-8-25(22-21-14)7-13-6-23-5-12(11-2-3-11)4-15(16(23)20-13)24-9-18-19-10-24;25-16(26)13-7-24(21-20-13)6-12-5-22-4-11(10-1-2-10)3-14(15(22)19-12)23-8-17-18-9-23;1-23-15(22)13-8-21(19-18-13)7-11-6-20-5-10(9-2-3-9)4-12(16)14(20)17-11;9-5-1-2-13-4-12-6(3-11)8(13)7(5)10;1-5(2,3)8-4(6)7;1-5-4(6-2)7-3;;1-3-2;;/h5-9,11-14H,1-4,10H2;9-11,13-14H,7-8,12H2,1-6H3,(H,25,31);6-8,10-11H,4-5,9H2,1-3H3;4-6,8-11H,2-3,7H2,1H3;3-5,7-10H,1-2,6H2,(H,25,26);4-6,8-9H,2-3,7,16H2,1H3;1-2,4H,3,11H2;1-3H3,(H2,6,7);4H,1-3H3;;;;1H2/q;;;;;;;;;+1;-1;+1;/p-1
InChIKeyYFSPHJAUKRQCPT-UHFFFAOYSA-M
XLogP11.75
TPSA846.33 Ų
H-Bond Donors5
H-Bond Acceptors64
Rotatable Bonds35
Heavy Atoms207
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002943.66
LogP ≤ 511.75
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1064

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide with MolForge

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Frequently Asked Questions

What is the IUPAC name of lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide?
The IUPAC name of lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide (CID 159323208) is lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide.
What is the SMILES notation for lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide?
The canonical SMILES for lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide is CC(C)(C)OC(=O)Nc1cc(C2CC2)cn2cc(Cn3cc(C(=O)OC(C)(C)C)nn3)nc12.CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(Br)c3n2)nn1.CC(C)(C)OC(N)=O.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnc4)c3n2)nn1.COC(=O)c1cn(Cc2cn3cc(C4CC4)cc(N)c3n2)nn1.COC(OC)OC.NCc1ncn2ccc(Cl)c(F)c12.O=C(CCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnn4)c3n2)nn1.O=C(O)c1cn(Cc2cn3cc(C4CC4)cc(-n4cnnc4)c3n2)nn1.[Li+].[N-]=[N+]=[N-].[Na+].[OH-].
What is the InChIKey of lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide?
The InChIKey is YFSPHJAUKRQCPT-UHFFFAOYSA-M. The full InChI is InChI=1S/C24H19ClFN11O.C23H30N6O4.C18H20BrN5O2.C17H16N8O2.C16H14N8O2.C15H16N6O2.C8H7ClFN3.C5H11NO2.C4H10O3.Li.N3.Na.H2O/c25-17-5-6-34-12-27-18(23(34)22(17)26)3-4-21(38)19-11-36(32-30-19)10-16-9-35-8-15(14-1-2-14)7-20(24(35)29-16)37-13-28-31-33-37;1-22(2,3)32-20(30)18-13-29(27-26-18)12-16-11-28-10-15(14-7-8-14)9-17(19(28)24-16)25-21(31)33-23(4,5)6;1-18(2,3)26-17(25)15-10-24(22-21-15)9-13-8-23-7-12(11-4-5-11)6-14(19)16(23)20-13;1-27-17(26)14-8-25(22-21-14)7-13-6-23-5-12(11-2-3-11)4-15(16(23)20-13)24-9-18-19-10-24;25-16(26)13-7-24(21-20-13)6-12-5-22-4-11(10-1-2-10)3-14(15(22)19-12)23-8-17-18-9-23;1-23-15(22)13-8-21(19-18-13)7-11-6-20-5-10(9-2-3-9)4-12(16)14(20)17-11;9-5-1-2-13-4-12-6(3-11)8(13)7(5)10;1-5(2,3)8-4(6)7;1-5-4(6-2)7-3;;1-3-2;;/h5-9,11-14H,1-4,10H2;9-11,13-14H,7-8,12H2,1-6H3,(H,25,31);6-8,10-11H,4-5,9H2,1-3H3;4-6,8-11H,2-3,7H2,1H3;3-5,7-10H,1-2,6H2,(H,25,26);4-6,8-9H,2-3,7,16H2,1H3;1-2,4H,3,11H2;1-3H3,(H2,6,7);4H,1-3H3;;;;1H2/q;;;;;;;;;+1;-1;+1;/p-1.
What are the key properties of lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide?
lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide has a molecular weight of 2943.66 g/mol, XLogP of 11.75, 35 rotatable bonds, 5 hydrogen bond donors, and 64 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;sodium;tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl carbamate;tert-butyl 1-[[6-cyclopropyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(tetrazol-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]propan-1-one;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;methyl 1-[(8-amino-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;methyl 1-[[6-cyclopropyl-8-(1,2,4-triazol-4-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;trimethoxymethane;azide;hydroxide is sourced from PubChem (CID 159323208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).