tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate

C97H82BCl3F14N8O19 — CID 162112177

IUPACtert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate
SMILESCC(C)(C)OC(=O)Nc1c(F)cccc1F.CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1F.CCOC(=O)c1ccc(N(C(=O)OC(C)(C)C)c2c(F)cccc2F)nc1-c1ccc(F)cc1F.CCOC(=O)c1cccnc1-c1ccc(F)cc1F.CCOC(=O)c1cccnc1Cl.COC(=O)c1ccc[n+]([O-])c1-c1ccc(F)cc1F.O=C(O)c1cccnc1Cl.OB(O)c1ccc(F)cc1F
InChIInChI=1S/C25H22F4N2O4.C14H10ClF2NO2.C14H11F2NO2.C13H9F2NO3.C11H13F2NO2.C8H8ClNO2.C6H5BF2O2.C6H4ClNO2/c1-5-34-23(32)16-11-12-20(30-21(16)15-10-9-14(26)13-19(15)29)31(24(33)35-25(2,3)4)22-17(27)7-6-8-18(22)28;1-2-20-14(19)10-5-6-12(15)18-13(10)9-4-3-8(16)7-11(9)17;1-2-19-14(18)11-4-3-7-17-13(11)10-6-5-9(15)8-12(10)16;1-19-13(17)10-3-2-6-16(18)12(10)9-5-4-8(14)7-11(9)15;1-11(2,3)16-10(15)14-9-7(12)5-4-6-8(9)13;1-2-12-8(11)6-4-3-5-10-7(6)9;8-4-1-2-5(7(10)11)6(9)3-4;7-5-4(6(9)10)2-1-3-8-5/h6-13H,5H2,1-4H3;3-7H,2H2,1H3;3-8H,2H2,1H3;2-7H,1H3;4-6H,1-3H3,(H,14,15);3-5H,2H2,1H3;1-3,10-11H;1-3H,(H,9,10)
InChIKeyZGHIJIPHXAVCKX-UHFFFAOYSA-N
MW2046.90 g/mol
LogP21.97
Rot. Bonds18

About tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate

tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate (PubChem CID 162112177) has the molecular formula C97H82BCl3F14N8O19 and a molecular weight of 2046.90 g/mol. Its IUPAC name is tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate.

Molecular Properties

Compound Nametert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate
PubChem CID162112177
Molecular FormulaC97H82BCl3F14N8O19
Molecular Weight2046.90 g/mol
Exact Mass2044.46
IUPAC Nametert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate
SMILESCC(C)(C)OC(=O)Nc1c(F)cccc1F.CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1F.CCOC(=O)c1ccc(N(C(=O)OC(C)(C)C)c2c(F)cccc2F)nc1-c1ccc(F)cc1F.CCOC(=O)c1cccnc1-c1ccc(F)cc1F.CCOC(=O)c1cccnc1Cl.COC(=O)c1ccc[n+]([O-])c1-c1ccc(F)cc1F.O=C(O)c1cccnc1Cl.OB(O)c1ccc(F)cc1F
InChIInChI=1S/C25H22F4N2O4.C14H10ClF2NO2.C14H11F2NO2.C13H9F2NO3.C11H13F2NO2.C8H8ClNO2.C6H5BF2O2.C6H4ClNO2/c1-5-34-23(32)16-11-12-20(30-21(16)15-10-9-14(26)13-19(15)29)31(24(33)35-25(2,3)4)22-17(27)7-6-8-18(22)28;1-2-20-14(19)10-5-6-12(15)18-13(10)9-4-3-8(16)7-11(9)17;1-2-19-14(18)11-4-3-7-17-13(11)10-6-5-9(15)8-12(10)16;1-19-13(17)10-3-2-6-16(18)12(10)9-5-4-8(14)7-11(9)15;1-11(2,3)16-10(15)14-9-7(12)5-4-6-8(9)13;1-2-12-8(11)6-4-3-5-10-7(6)9;8-4-1-2-5(7(10)11)6(9)3-4;7-5-4(6(9)10)2-1-3-8-5/h6-13H,5H2,1-4H3;3-7H,2H2,1H3;3-8H,2H2,1H3;2-7H,1H3;4-6H,1-3H3,(H,14,15);3-5H,2H2,1H3;1-3,10-11H;1-3H,(H,9,10)
InChIKeyZGHIJIPHXAVCKX-UHFFFAOYSA-N
XLogP21.97
TPSA368.52 Ų
H-Bond Donors4
H-Bond Acceptors23
Rotatable Bonds18
Heavy Atoms142
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002046.90
LogP ≤ 521.97
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate with MolForge

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Related Compounds

1-[3,5-bis(trifluoromethyl)phenyl]-N-methylmethanamine;N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-6-(4-methylpiperazin-1-yl)-4-(2-methyl-3-pyridinyl)pyridine-3-carboxamide;methyl 4-chloro-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylate;methyl 6-(4-methylpiperazin-1-yl)-4-(2-methyl-3-pyridinyl)pyridine-3-carboxylate;6-(4-methylpiperazin-1-yl)-4-(2-methyl-3-pyridinyl)pyridine-3-carbonyl chloride;6-(4-methylpiperazin-1-yl)-4-(2-methyl-3-pyridinyl)pyridine-3-carboxylic acid;(2-methyl-3-pyridinyl)boronic acid;thionyl dichloride;iodide
CID 158753519
tetrakis(2-tert-butylperoxy-2-methylpropane);carbon monoxide;2,6-dichloropyridine-3-carboxylic acid;methyl 2-amino-6-chloropyridine-3-carboxylate;methyl 2-amino-6-ethenylpyridine-3-carboxylate;methyl 6-[5-[3,5-bis(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]-2-formamidopyridine-3-carboxylate;methyl 2,6-dichloropyridine-3-carboxylate;methyl 6-ethenyl-2-formamidopyridine-3-carboxylate;methyl 2-formamido-6-formylpyridine-3-carboxylate;methyl 2-formamido-6-[(E)-hydroxyiminomethyl]pyridine-3-carboxylate;2-methyl-2-[(2-methylpropan-2-yl)oxyperoxy]propane;1-methyl-3-(trifluoromethyl)-5-(3,3,3-trifluoroprop-1-en-2-yl)benzene;tributyl(ethenyl)stannane
CID 172929113
tris(2-tert-butylperoxy-2-methylpropane);carbon monoxide;2,6-dichloropyridine-3-carboxylic acid;methyl 2-amino-6-chloropyridine-3-carboxylate;methyl 2-amino-6-ethenylpyridine-3-carboxylate;methyl 2,6-dichloropyridine-3-carboxylate;methyl 6-ethenyl-2-formamidopyridine-3-carboxylate;methyl 2-formamido-6-formylpyridine-3-carboxylate;methyl 2-formamido-6-[(E)-hydroxyiminomethyl]pyridine-3-carboxylate;2-methyl-2-[(2-methylpropan-2-yl)oxyperoxy]propane;1-methyl-3-(trifluoromethyl)-5-(3,3,3-trifluoroprop-1-en-2-yl)benzene;tributyl(ethenyl)stannane
CID 172932378
(2,4-Difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)-1-hydroxypyridin-1-ium-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methane
CID 157064540
acetyl acetate;tert-butyl N-[2-[2-oxo-2-(2-piperidin-1-ylquinolin-6-yl)ethyl]phenyl]carbamate;methyl 2-chloroquinoline-6-carboxylate;methyl 1-oxidoquinolin-1-ium-6-carboxylate;methyl 2-oxo-1H-quinoline-6-carboxylate;methyl 2-piperidin-1-ylquinoline-6-carboxylate;methyl quinoline-6-carboxylate;2-piperidin-1-ylquinoline-6-carboxylic acid
CID 157210072
tert-butyl 4-[6-chloro-7-(2-fluorophenyl)-3-isocyano-1-(4-methyl-2-propan-2-yl-3-pyridinyl)-2-oxo-1,8-naphthyridin-4-yl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;6-chloro-7-(2-fluorophenyl)-4-hydroxy-3-isocyano-1-(4-methyl-2-propan-2-yl-3-pyridinyl)-1,8-naphthyridin-2-one;6-chloro-7-(2-fluorophenyl)-1-(4-methyl-2-propan-2-yl-3-pyridinyl)-2-oxo-4-piperazin-1-yl-1,8-naphthyridine-3-carboxamide;6-chloro-7-(2-fluorophenyl)-1-(4-methyl-2-propan-2-yl-3-pyridinyl)-2-oxo-4-(4-prop-2-enoylpiperazin-1-yl)-1,8-naphthyridine-3-carboxamide;2-cyanoacetic acid;2-cyano-N-(4-methyl-2-propan-2-yl-3-pyridinyl)acetamide;2,5-dichloro-6-(2-fluorophenyl)pyridine-3-carbonyl chloride;2,5-dichloro-6-(2-fluorophenyl)pyridine-3-carboxylic acid;methane;4-methyl-2-propan-2-ylpyridin-3-amine
CID 157390853
magnesium;sodium;aniline;1-(2-anilino-3-pyridinyl)ethanone;carbanide;2-chloro-N-methoxy-N-methylpyridine-3-carboxamide;2-chloropyridine-3-carboxylic acid;1-(2-chloro-3-pyridinyl)ethanone;methanolate;N-methoxymethanamine;methyl 4-[(E)-3-(2-anilino-3-pyridinyl)-3-oxoprop-1-enyl]-3-fluorobenzoate;methyl 3-fluoro-4-formylbenzoate;chloride
CID 157575647
magnesium;sodium;aniline;1-(2-anilino-3-pyridinyl)ethanone;carbanide;2-chloro-N-methoxy-N-methylpyridine-3-carboxamide;2-chloropyridine-3-carboxylic acid;1-(2-chloro-3-pyridinyl)ethanone;methanolate;N-methoxymethanamine;methyl 4-[(E)-3-(2-anilino-3-pyridinyl)-3-oxoprop-1-enyl]benzoate;methyl 4-formylbenzoate;chloride
CID 157799302
ethyl 1-oxido-5-[3-[4-oxo-3-(propan-2-ylcarbamoyl)-1,8-naphthyridin-1-yl]phenyl]pyridin-1-ium-3-carboxylate;1-[3-[5-(2-hydroxypropan-2-yl)-1-oxidopyridin-1-ium-3-yl]phenyl]-4-oxo-N-propan-2-yl-1,8-naphthyridine-3-carboxamide;1-[3-[5-(2-hydroxypropan-2-yl)-3-pyridinyl]phenyl]-4-oxo-N-propan-2-yl-1,8-naphthyridine-3-carboxamide;1-[3-[6-(2-methylpropyl)-3-pyridinyl]phenyl]-4-oxo-N-propan-2-yl-1,8-naphthyridine-3-carboxamide
CID 157813790
Tert-butyl 3-[3-(aminomethyl)-2-pyridinyl]propanoate;tert-butyl 3-[3-[[[6-chloro-2-[2-(3-fluorophenyl)ethylamino]pyridine-3-carbonyl]amino]methyl]-2-pyridinyl]propanoate;6-chloro-2-[2-(3-fluorophenyl)ethylamino]pyridine-3-carboxylic acid
CID 157847314
tert-butyl N-(2,6-difluorophenyl)carbamate;methane;methyl 6-chloro-2-(4-fluorophenyl)pyridine-3-carboxylate;methyl 6-(2,6-difluoroanilino)-2-(4-fluorophenyl)pyridine-3-carboxylate;methyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(4-fluorophenyl)pyridine-3-carboxylate
CID 157959876
tert-butyl N-[[3-(aminomethyl)-2-pyridinyl]methyl]carbamate;tert-butyl N-[[3-[[[6-chloro-2-[2-(3-fluorophenyl)ethylamino]pyridine-3-carbonyl]amino]methyl]-2-pyridinyl]methyl]carbamate;6-chloro-2-[2-(3-fluorophenyl)ethylamino]pyridine-3-carboxylic acid
CID 158008323

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate?
The IUPAC name of tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate (CID 162112177) is tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate.
What is the SMILES notation for tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate?
The canonical SMILES for tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate is CC(C)(C)OC(=O)Nc1c(F)cccc1F.CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1F.CCOC(=O)c1ccc(N(C(=O)OC(C)(C)C)c2c(F)cccc2F)nc1-c1ccc(F)cc1F.CCOC(=O)c1cccnc1-c1ccc(F)cc1F.CCOC(=O)c1cccnc1Cl.COC(=O)c1ccc[n+]([O-])c1-c1ccc(F)cc1F.O=C(O)c1cccnc1Cl.OB(O)c1ccc(F)cc1F.
What is the InChIKey of tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate?
The InChIKey is ZGHIJIPHXAVCKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F4N2O4.C14H10ClF2NO2.C14H11F2NO2.C13H9F2NO3.C11H13F2NO2.C8H8ClNO2.C6H5BF2O2.C6H4ClNO2/c1-5-34-23(32)16-11-12-20(30-21(16)15-10-9-14(26)13-19(15)29)31(24(33)35-25(2,3)4)22-17(27)7-6-8-18(22)28;1-2-20-14(19)10-5-6-12(15)18-13(10)9-4-3-8(16)7-11(9)17;1-2-19-14(18)11-4-3-7-17-13(11)10-6-5-9(15)8-12(10)16;1-19-13(17)10-3-2-6-16(18)12(10)9-5-4-8(14)7-11(9)15;1-11(2,3)16-10(15)14-9-7(12)5-4-6-8(9)13;1-2-12-8(11)6-4-3-5-10-7(6)9;8-4-1-2-5(7(10)11)6(9)3-4;7-5-4(6(9)10)2-1-3-8-5/h6-13H,5H2,1-4H3;3-7H,2H2,1H3;3-8H,2H2,1H3;2-7H,1H3;4-6H,1-3H3,(H,14,15);3-5H,2H2,1H3;1-3,10-11H;1-3H,(H,9,10).
What are the key properties of tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate?
tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate has a molecular weight of 2046.90 g/mol, XLogP of 21.97, 18 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(2,6-difluorophenyl)carbamate;2-chloropyridine-3-carboxylic acid;(2,4-difluorophenyl)boronic acid;ethyl 6-chloro-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-chloropyridine-3-carboxylate;ethyl 6-[2,6-difluoro-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-2-(2,4-difluorophenyl)pyridine-3-carboxylate;ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate;methyl 2-(2,4-difluorophenyl)-1-oxidopyridin-1-ium-3-carboxylate is sourced from PubChem (CID 162112177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).