lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate

C143H154Br2Cl6F11LiN20O31 — CID 158756009

About lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate

lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate (PubChem CID 158756009) has the molecular formula C143H154Br2Cl6F11LiN20O31 and a molecular weight of 3237.36 g/mol. Its IUPAC name is lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate.

Molecular Properties

• Compound Name: lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate
• PubChem CID: 158756009
• Molecular Formula: C143H154Br2Cl6F11LiN20O31
• Molecular Weight: 3237.36 g/mol
• Exact Mass: 3230.76
• IUPAC Name: lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate
• SMILES: C.C.C.COC(=O)c1ccc(N)c(NC[C@@H]2CCO2)c1F.COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCO2)c1F.COC(=O)c1ccc2nc(CCl)n(C[C@@H]3CCO3)c2c1F.COC(=O)c1ccc2nc(CN3CC=C(c4cccc(OCc5ccc(Cl)cc5F)n4)CC3)n(C[C@@H]3CCO3)c2c1F.Fc1cc(Cl)ccc1COc1cccc(C2=CCNCC2)n1.NC[C@@H]1CCO1.O.O=C(CCl)OC(=O)CCl.O=C(O)c1ccc2nc(CN3CC=C(c4cccc(OCc5ccc(Cl)cc5F)n4)CC3)n(C[C@@H]3CCO3)c2c1F.O=[N+]([O-])c1ccc(Br)c(F)c1F.O=[N+]([O-])c1ccc(Br)c(F)c1NC[C@@H]1CCO1.[Li+].[OH-]
• InChI: InChI=1S/C31H29ClF2N4O4.C30H27ClF2N4O4.C17H16ClFN2O.C14H14ClFN2O3.C12H13FN2O5.C12H15FN2O3.C10H10BrFN2O3.C6H2BrF2NO2.C4H4Cl2O3.C4H9NO.3CH4.Li.2H2O/c1-40-31(39)23-7-8-26-30(29(23)34)38(16-22-11-14-41-22)27(35-26)17-37-12-9-19(10-13-37)25-3-2-4-28(36-25)42-18-20-5-6-21(32)15-24(20)33;31-20-5-4-19(23(32)14-20)17-41-27-3-1-2-24(35-27)18-8-11-36(12-9-18)16-26-34-25-7-6-22(30(38)39)28(33)29(25)37(26)15-21-10-13-40-21;18-14-5-4-13(15(19)10-14)11-22-17-3-1-2-16(21-17)12-6-8-20-9-7-12;1-20-14(19)9-2-3-10-13(12(9)16)18(11(6-15)17-10)7-8-4-5-21-8;1-19-12(16)8-2-3-9(15(17)18)11(10(8)13)14-6-7-4-5-20-7;1-17-12(16)8-2-3-9(14)11(10(8)13)15-6-7-4-5-18-7;11-7-1-2-8(14(15)16)10(9(7)12)13-5-6-3-4-17-6;7-3-1-2-4(10(11)12)6(9)5(3)8;5-1-3(7)9-4(8)2-6;5-3-4-1-2-6-4;;;;;;/h2-9,15,22H,10-14,16-18H2,1H3;1-8,14,21H,9-13,15-17H2,(H,38,39);1-6,10,20H,7-9,11H2;2-3,8H,4-7H2,1H3;2-3,7,14H,4-6H2,1H3;2-3,7,15H,4-6,14H2,1H3;1-2,6,13H,3-5H2;1-2H;1-2H2;4H,1-3,5H2;3*1H4;;2*1H2/q;;;;;;;;;;;;;+1;;/p-1/t22-;21-;;8-;2*7-;6-;;;4-;;;;;;/m00.0000..0....../s1
• InChIKey: YTKCHIAFLYJXJO-IHNIXZHQSA-M
• XLogP: 24.47
• TPSA: 667.86 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 46
• Rotatable Bonds: 43
• Heavy Atoms: 214
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3237.36
LogP ≤ 5	24.47
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	46

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate?

The IUPAC name of lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate (CID 158756009) is lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate.

What is the SMILES notation for lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate?

The canonical SMILES for lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate is C.C.C.COC(=O)c1ccc(N)c(NC[C@@H]2CCO2)c1F.COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCO2)c1F.COC(=O)c1ccc2nc(CCl)n(C[C@@H]3CCO3)c2c1F.COC(=O)c1ccc2nc(CN3CC=C(c4cccc(OCc5ccc(Cl)cc5F)n4)CC3)n(C[C@@H]3CCO3)c2c1F.Fc1cc(Cl)ccc1COc1cccc(C2=CCNCC2)n1.NC[C@@H]1CCO1.O.O=C(CCl)OC(=O)CCl.O=C(O)c1ccc2nc(CN3CC=C(c4cccc(OCc5ccc(Cl)cc5F)n4)CC3)n(C[C@@H]3CCO3)c2c1F.O=[N+]([O-])c1ccc(Br)c(F)c1F.O=[N+]([O-])c1ccc(Br)c(F)c1NC[C@@H]1CCO1.[Li+].[OH-].

What is the InChIKey of lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate?

The InChIKey is YTKCHIAFLYJXJO-IHNIXZHQSA-M. The full InChI is InChI=1S/C31H29ClF2N4O4.C30H27ClF2N4O4.C17H16ClFN2O.C14H14ClFN2O3.C12H13FN2O5.C12H15FN2O3.C10H10BrFN2O3.C6H2BrF2NO2.C4H4Cl2O3.C4H9NO.3CH4.Li.2H2O/c1-40-31(39)23-7-8-26-30(29(23)34)38(16-22-11-14-41-22)27(35-26)17-37-12-9-19(10-13-37)25-3-2-4-28(36-25)42-18-20-5-6-21(32)15-24(20)33;31-20-5-4-19(23(32)14-20)17-41-27-3-1-2-24(35-27)18-8-11-36(12-9-18)16-26-34-25-7-6-22(30(38)39)28(33)29(25)37(26)15-21-10-13-40-21;18-14-5-4-13(15(19)10-14)11-22-17-3-1-2-16(21-17)12-6-8-20-9-7-12;1-20-14(19)9-2-3-10-13(12(9)16)18(11(6-15)17-10)7-8-4-5-21-8;1-19-12(16)8-2-3-9(15(17)18)11(10(8)13)14-6-7-4-5-20-7;1-17-12(16)8-2-3-9(14)11(10(8)13)15-6-7-4-5-18-7;11-7-1-2-8(14(15)16)10(9(7)12)13-5-6-3-4-17-6;7-3-1-2-4(10(11)12)6(9)5(3)8;5-1-3(7)9-4(8)2-6;5-3-4-1-2-6-4;;;;;;/h2-9,15,22H,10-14,16-18H2,1H3;1-8,14,21H,9-13,15-17H2,(H,38,39);1-6,10,20H,7-9,11H2;2-3,8H,4-7H2,1H3;2-3,7,14H,4-6H2,1H3;2-3,7,15H,4-6,14H2,1H3;1-2,6,13H,3-5H2;1-2H;1-2H2;4H,1-3,5H2;3*1H4;;2*1H2/q;;;;;;;;;;;;;+1;;/p-1/t22-;21-;;8-;2*7-;6-;;;4-;;;;;;/m00.0000..0....../s1.

What are the key properties of lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate?

lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate has a molecular weight of 3237.36 g/mol, XLogP of 24.47, 43 rotatable bonds, 7 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;1-bromo-2,3-difluoro-4-nitrobenzene;3-bromo-2-fluoro-6-nitro-N-[[(2S)-oxetan-2-yl]methyl]aniline;(2-chloroacetyl) 2-chloroacetate;2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylic acid;2-[(4-chloro-2-fluorophenyl)methoxy]-6-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;methane;methyl 4-amino-2-fluoro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;methyl 2-[[4-[6-[(4-chloro-2-fluorophenyl)methoxy]-2-pyridinyl]-3,6-dihydro-2H-pyridin-1-yl]methyl]-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-(chloromethyl)-4-fluoro-3-[[(2S)-oxetan-2-yl]methyl]benzimidazole-5-carboxylate;methyl 2-fluoro-4-nitro-3-[[(2S)-oxetan-2-yl]methylamino]benzoate;[(2S)-oxetan-2-yl]methanamine;hydroxide;hydrate is sourced from PubChem (CID 158756009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).