Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide
C113H132Cl5LiN30NaO21- — CID 159039882
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAClithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide
SMILESCCO/C=C(\C(=O)CCl)C(=O)OCC.CCOC(=O)CC(=O)CCl.CCOC(=O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)nc1CC1=NCN=N1.CCOC(=O)c1cn[nH]c1CCl.CCOC(C)OCC.ClCc1cn2cc(C3CC3)ccc2n1.NCc1ncn2ccc(Cl)cc12.O=C(O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)nc1CC1=NCN=N1.[C-]#N.[C-]#[N+]Cc1[nH]ncc1C(=O)OCC.[C-]#[N+]Cc1nn(Cc2cn3cc(C4CC4)ccc3n2)cc1C(=O)OCC.[Li+].[Na+].[OH-].[OH-]
InChIInChI=1S/C20H21N7O2.C19H19N5O2.C18H17N7O2.C11H11ClN2.C9H13ClO4.C8H8ClN3.C8H9N3O2.C7H9ClN2O2.C6H9ClO3.C6H14O2.CN.Li.Na.2H2O/c1-2-29-20(28)16-11-27(25-17(16)7-18-21-12-22-24-18)10-15-9-26-8-14(13-3-4-13)5-6-19(26)23-15;1-3-26-19(25)16-12-24(22-17(16)8-20-2)11-15-10-23-9-14(13-4-5-13)6-7-18(23)21-15;26-18(27)14-9-25(23-15(14)5-16-19-10-20-22-16)8-13-7-24-6-12(11-1-2-11)3-4-17(24)21-13;12-5-10-7-14-6-9(8-1-2-8)3-4-11(14)13-10;1-3-13-6-7(8(11)5-10)9(12)14-4-2;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-3-13-8(12)6-4-10-11-7(6)5-9-2;1-2-12-7(11)5-4-9-10-6(5)3-8;1-2-10-6(9)3-5(8)4-7;1-4-7-6(3)8-5-2;1-2;;;;/h5-6,8-9,11,13H,2-4,7,10,12H2,1H3;6-7,9-10,12-13H,3-5,8,11H2,1H3;3-4,6-7,9,11H,1-2,5,8,10H2,(H,26,27);3-4,6-8H,1-2,5H2;6H,3-5H2,1-2H3;1-3,5H,4,10H2;4H,3,5H2,1H3,(H,10,11);4H,2-3H2,1H3,(H,9,10);2-4H2,1H3;6H,4-5H2,1-3H3;;;;2*1H2/q;;;;;;;;;;-1;2*+1;;/p-2/b;;;;7-6+;;;;;;;;;;
InChIKeyRTQKWHBRXNECAL-QPIUUYTESA-L
MW2453.68 g/mol
LogP12.48
Rot. Bonds42
About Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide
Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide (PubChem CID 159039882) has the molecular formula C113H132Cl5LiN30NaO21- and a molecular weight of 2453.68 g/mol. Its IUPAC name is lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide.
Molecular Properties
| Compound Name | Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide |
|---|---|
| PubChem CID | 159039882 |
| Molecular Formula | C113H132Cl5LiN30NaO21- |
| Molecular Weight | 2453.68 g/mol |
| Exact Mass | 2449.87 |
| IUPAC Name | lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide |
| SMILES | CCO/C=C(\C(=O)CCl)C(=O)OCC.CCOC(=O)CC(=O)CCl.CCOC(=O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)nc1CC1=NCN=N1.CCOC(=O)c1cn[nH]c1CCl.CCOC(C)OCC.ClCc1cn2cc(C3CC3)ccc2n1.NCc1ncn2ccc(Cl)cc12.O=C(O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)nc1CC1=NCN=N1.[C-]#N.[C-]#[N+]Cc1[nH]ncc1C(=O)OCC.[C-]#[N+]Cc1nn(Cc2cn3cc(C4CC4)ccc3n2)cc1C(=O)OCC.[Li+].[Na+].[OH-].[OH-] |
| InChI | InChI=1S/C20H21N7O2.C19H19N5O2.C18H17N7O2.C11H11ClN2.C9H13ClO4.C8H8ClN3.C8H9N3O2.C7H9ClN2O2.C6H9ClO3.C6H14O2.CN.Li.Na.2H2O/c1-2-29-20(28)16-11-27(25-17(16)7-18-21-12-22-24-18)10-15-9-26-8-14(13-3-4-13)5-6-19(26)23-15;1-3-26-19(25)16-12-24(22-17(16)8-20-2)11-15-10-23-9-14(13-4-5-13)6-7-18(23)21-15;26-18(27)14-9-25(23-15(14)5-16-19-10-20-22-16)8-13-7-24-6-12(11-1-2-11)3-4-17(24)21-13;12-5-10-7-14-6-9(8-1-2-8)3-4-11(14)13-10;1-3-13-6-7(8(11)5-10)9(12)14-4-2;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-3-13-8(12)6-4-10-11-7(6)5-9-2;1-2-12-7(11)5-4-9-10-6(5)3-8;1-2-10-6(9)3-5(8)4-7;1-4-7-6(3)8-5-2;1-2;;;;/h5-6,8-9,11,13H,2-4,7,10,12H2,1H3;6-7,9-10,12-13H,3-5,8,11H2,1H3;3-4,6-7,9,11H,1-2,5,8,10H2,(H,26,27);3-4,6-8H,1-2,5H2;6H,3-5H2,1-2H3;1-3,5H,4,10H2;4H,3,5H2,1H3,(H,10,11);4H,2-3H2,1H3,(H,9,10);2-4H2,1H3;6H,4-5H2,1-3H3;;;;2*1H2/q;;;;;;;;;;-1;2*+1;;/p-2/b;;;;7-6+;;;;;;;;;; |
| InChIKey | RTQKWHBRXNECAL-QPIUUYTESA-L |
| XLogP | 12.48 |
| TPSA | 646.94 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 46 |
| Rotatable Bonds | 42 |
| Heavy Atoms | 171 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2453.68 |
| LogP ≤ 5 | 12.48 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 46 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide?
The IUPAC name of Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide (CID 159039882) is lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide.
What is the SMILES notation for Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide?
The canonical SMILES for Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide is CCO/C=C(\C(=O)CCl)C(=O)OCC.CCOC(=O)CC(=O)CCl.CCOC(=O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)nc1CC1=NCN=N1.CCOC(=O)c1cn[nH]c1CCl.CCOC(C)OCC.ClCc1cn2cc(C3CC3)ccc2n1.NCc1ncn2ccc(Cl)cc12.O=C(O)c1cn(Cc2cn3cc(C4CC4)ccc3n2)nc1CC1=NCN=N1.[C-]#N.[C-]#[N+]Cc1[nH]ncc1C(=O)OCC.[C-]#[N+]Cc1nn(Cc2cn3cc(C4CC4)ccc3n2)cc1C(=O)OCC.[Li+].[Na+].[OH-].[OH-].
What is the InChIKey of Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide?
The InChIKey is RTQKWHBRXNECAL-QPIUUYTESA-L. The full InChI is InChI=1S/C20H21N7O2.C19H19N5O2.C18H17N7O2.C11H11ClN2.C9H13ClO4.C8H8ClN3.C8H9N3O2.C7H9ClN2O2.C6H9ClO3.C6H14O2.CN.Li.Na.2H2O/c1-2-29-20(28)16-11-27(25-17(16)7-18-21-12-22-24-18)10-15-9-26-8-14(13-3-4-13)5-6-19(26)23-15;1-3-26-19(25)16-12-24(22-17(16)8-20-2)11-15-10-23-9-14(13-4-5-13)6-7-18(23)21-15;26-18(27)14-9-25(23-15(14)5-16-19-10-20-22-16)8-13-7-24-6-12(11-1-2-11)3-4-17(24)21-13;12-5-10-7-14-6-9(8-1-2-8)3-4-11(14)13-10;1-3-13-6-7(8(11)5-10)9(12)14-4-2;9-6-1-2-12-5-11-7(4-10)8(12)3-6;1-3-13-8(12)6-4-10-11-7(6)5-9-2;1-2-12-7(11)5-4-9-10-6(5)3-8;1-2-10-6(9)3-5(8)4-7;1-4-7-6(3)8-5-2;1-2;;;;/h5-6,8-9,11,13H,2-4,7,10,12H2,1H3;6-7,9-10,12-13H,3-5,8,11H2,1H3;3-4,6-7,9,11H,1-2,5,8,10H2,(H,26,27);3-4,6-8H,1-2,5H2;6H,3-5H2,1-2H3;1-3,5H,4,10H2;4H,3,5H2,1H3,(H,10,11);4H,2-3H2,1H3,(H,9,10);2-4H2,1H3;6H,4-5H2,1-3H3;;;;2*1H2/q;;;;;;;;;;-1;2*+1;;/p-2/b;;;;7-6+;;;;;;;;;;.
What are the key properties of Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide?
Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide has a molecular weight of 2453.68 g/mol, XLogP of 12.48, 42 rotatable bonds, 4 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for Lithium;sodium;(7-chloroimidazo[1,5-a]pyridin-1-yl)methanamine;2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine;1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylic acid;1,1-diethoxyethane;ethyl (2E)-4-chloro-2-(ethoxymethylidene)-3-oxobutanoate;ethyl 5-(chloromethyl)-1H-pyrazole-4-carboxylate;ethyl 4-chloro-3-oxobutanoate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(isocyanomethyl)pyrazole-4-carboxylate;ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(3H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxylate;ethyl 5-(isocyanomethyl)-1H-pyrazole-4-carboxylate;cyanide;dihydroxide is sourced from PubChem (CID 159039882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 159039882 — identifiers, structure, computed properties (public domain)
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