(3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate

C90H65BCl7F6N21O15 — CID 163471993

IUPAC(3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate
SMILESCOC(=O)c1cc(-c2cc(F)cc(Cl)c2)ncn1.COC(=O)c1cc(Cl)ncn1.COc1ncc(CC(=O)c2cc(-c3cc(F)cc(Cl)c3)ncn2)cn1.COc1ncc(N)cn1.Cn1cc(CC(=O)c2cc(-c3cc(F)cc(Cl)c3)ncn2)cnc1=O.O=C(Cc1cnc(=O)[nH]c1)c1cc(-c2cc(F)cc(Cl)c2)ncn1.O=C(O)c1cc(-c2cc(F)cc(Cl)c2)ncn1.OB(O)c1cc(F)cc(Cl)c1
InChIInChI=1S/2C17H12ClFN4O2.C16H10ClFN4O2.C12H8ClFN2O2.C11H6ClFN2O2.C6H5BClFO2.C6H5ClN2O2.C5H7N3O/c1-23-8-10(7-20-17(23)25)2-16(24)15-6-14(21-9-22-15)11-3-12(18)5-13(19)4-11;1-25-17-20-7-10(8-21-17)2-16(24)15-6-14(22-9-23-15)11-3-12(18)5-13(19)4-11;17-11-2-10(3-12(18)4-11)13-5-14(22-8-21-13)15(23)1-9-6-19-16(24)20-7-9;1-18-12(17)11-5-10(15-6-16-11)7-2-8(13)4-9(14)3-7;12-7-1-6(2-8(13)3-7)9-4-10(11(16)17)15-5-14-9;8-5-1-4(7(10)11)2-6(9)3-5;1-11-6(10)4-2-5(7)9-3-8-4;1-9-5-7-2-4(6)3-8-5/h2*3-9H,2H2,1H3;2-8H,1H2,(H,19,20,24);2-6H,1H3;1-5H,(H,16,17);1-3,10-11H;2-3H,1H3;2-3H,6H2,1H3
InChIKeyBXGSQEARZDDNAZ-UHFFFAOYSA-N
MW2053.61 g/mol
LogP14.56
Rot. Bonds20

About (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate

(3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate (PubChem CID 163471993) has the molecular formula C90H65BCl7F6N21O15 and a molecular weight of 2053.61 g/mol. Its IUPAC name is (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate.

Molecular Properties

Compound Name(3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate
PubChem CID163471993
Molecular FormulaC90H65BCl7F6N21O15
Molecular Weight2053.61 g/mol
Exact Mass2049.28
IUPAC Name(3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate
SMILESCOC(=O)c1cc(-c2cc(F)cc(Cl)c2)ncn1.COC(=O)c1cc(Cl)ncn1.COc1ncc(CC(=O)c2cc(-c3cc(F)cc(Cl)c3)ncn2)cn1.COc1ncc(N)cn1.Cn1cc(CC(=O)c2cc(-c3cc(F)cc(Cl)c3)ncn2)cnc1=O.O=C(Cc1cnc(=O)[nH]c1)c1cc(-c2cc(F)cc(Cl)c2)ncn1.O=C(O)c1cc(-c2cc(F)cc(Cl)c2)ncn1.OB(O)c1cc(F)cc(Cl)c1
InChIInChI=1S/2C17H12ClFN4O2.C16H10ClFN4O2.C12H8ClFN2O2.C11H6ClFN2O2.C6H5BClFO2.C6H5ClN2O2.C5H7N3O/c1-23-8-10(7-20-17(23)25)2-16(24)15-6-14(21-9-22-15)11-3-12(18)5-13(19)4-11;1-25-17-20-7-10(8-21-17)2-16(24)15-6-14(22-9-23-15)11-3-12(18)5-13(19)4-11;17-11-2-10(3-12(18)4-11)13-5-14(22-8-21-13)15(23)1-9-6-19-16(24)20-7-9;1-18-12(17)11-5-10(15-6-16-11)7-2-8(13)4-9(14)3-7;12-7-1-6(2-8(13)3-7)9-4-10(11(16)17)15-5-14-9;8-5-1-4(7(10)11)2-6(9)3-5;1-11-6(10)4-2-5(7)9-3-8-4;1-9-5-7-2-4(6)3-8-5/h2*3-9H,2H2,1H3;2-8H,1H2,(H,19,20,24);2-6H,1H3;1-5H,(H,16,17);1-3,10-11H;2-3H,1H3;2-3H,6H2,1H3
InChIKeyBXGSQEARZDDNAZ-UHFFFAOYSA-N
XLogP14.56
TPSA512.93 Ų
H-Bond Donors5
H-Bond Acceptors34
Rotatable Bonds20
Heavy Atoms140
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002053.61
LogP ≤ 514.56
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

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

Analyze (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate with MolForge

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Related Compounds

4-Amino-3-chloro-5-fluoro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-2-ethenyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[4-chloro-3-fluoro-2-(fluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(2,6-dichloro-3-pyridinyl)pyridine-2-carboxylate;methyl 6-amino-5-chloro-2-[2-fluoro-6-(trifluoromethyl)-3-pyridinyl]pyrimidine-4-carboxylate;methyl 4-amino-3-ethenyl-5-fluoro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate
CID 158295699
4-[2-(3-Chloro-4-fluoroanilino)-4-morpholin-4-ylpyrimidin-5-yl]pyridine-2-carboxylic acid;methyl 4-[2-(3-chloro-4-fluoroanilino)-4-morpholin-4-ylpyrimidin-5-yl]pyridine-2-carboxylate
CID 157410103
1-[5-(3-Chloroanilino)benzo[c][2,6]naphthyridin-8-yl]ethanone;1-[5-(3,5-difluoroanilino)pyrimido[4,5-c]quinolin-8-yl]ethanone;1-[5-(3-fluoroanilino)pyrimido[4,5-c]quinolin-8-yl]ethanone;methyl 5-chloropyrimido[4,5-c]quinoline-8-carboxylate;5-(2-phenylethylamino)benzo[c][2,6]naphthyridine-8-carboxylic acid
CID 157482182
Tert-butyl 4-[6-(3,4-dichlorophenyl)pyrimidine-4-carbonyl]piperazine-1-carboxylate;1-[4-[6-(3,4-dichlorophenyl)pyrimidine-4-carbonyl]piperazin-1-yl]-2-hydroxy-2-methylpropan-1-one;6-(3,4-dichlorophenyl)pyrimidine-4-carboxylic acid;[6-(3,4-dichlorophenyl)pyrimidin-4-yl]-piperazin-4-ium-1-ylmethanone;chloride
CID 157517874
CID 157581115
CID 157581115
Tert-butyl 4-[5-[2-[6-(3,4-dichlorophenyl)pyrimidin-4-yl]-2-oxoethyl]-2-pyridinyl]piperazine-1-carboxylate;6-(3,4-dichlorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3,4-dichlorophenyl)pyrimidin-4-yl]-2-(6-piperazin-1-yl-3-pyridinyl)ethanone;hydrochloride
CID 157749273
(4-Chloro-3-fluorophenyl)methanamine;deuterio(fluoro)methane;[3-fluoro-4-(2-methyl-4-pyridinyl)phenyl]methanamine;3-[3-fluoro-4-(2-methyl-4-pyridinyl)phenyl]-1-(4-pyrimidin-5-ylphenyl)propan-1-one;methane;(2-methyl-4-pyridinyl)boronic acid;4-pyrimidin-5-ylbenzoic acid
CID 157890973
4-chloro-2-(5-chloro-2-fluorophenyl)-N,N-dimethylpyrimidin-5-amine;2-(5-chloro-2-fluorophenyl)-5-(dimethylamino)-1H-pyrimidin-6-one;4-[[2-(5-chloro-2-fluorophenyl)-5-(dimethylamino)pyrimidin-4-yl]amino]-N-methylpyridine-3-carboxamide;4-[[2-(5-chloro-2-fluorophenyl)-5-(dimethylamino)pyrimidin-4-yl]amino]pyridine-3-carboxylic acid;methyl 4-[[2-(5-chloro-2-fluorophenyl)-5-(dimethylamino)pyrimidin-4-yl]amino]pyridine-3-carboxylate;methyl 2-(dimethylamino)acetate
CID 158038858
CID 158302152
CID 158302152
CID 158551030
CID 158551030
1-[(1S)-1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-4-[2-[(1-cyclopropyl-3-methylpyrazol-4-yl)amino]pyrimidin-4-yl]pyridin-2-one;1-[(1S)-1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-4-[2-[(1-cyclopropyl-5-methylpyrazol-4-yl)amino]pyrimidin-4-yl]pyridin-2-one;4-[[4-[1-[(1S)-1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-2-oxo-4-pyridinyl]pyrimidin-2-yl]amino]pyridine-2-carboxylic acid;1-[(1S)-1-(4-chlorophenyl)-2-hydroxyethyl]-4-[5-fluoro-2-[(2-methyl-4-pyridinyl)amino]pyrimidin-4-yl]pyridin-2-one;1-[(1S)-1-(4-chlorophenyl)-2-hydroxyethyl]-4-[5-fluoro-2-[(3-methyl-4-pyridinyl)amino]pyrimidin-4-yl]pyridin-2-one;methyl 4-[[4-[1-[(1S)-1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-2-oxo-4-pyridinyl]pyrimidin-2-yl]amino]pyridine-2-carboxylate
CID 159415850
N-(2-aminophenyl)-4-[[[4-[4-(morpholin-4-ylmethyl)phenyl]pyrimidin-2-yl]amino]methyl]benzamide;4-(2-chloropyrimidin-4-yl)benzaldehyde;4-[[4-(2-chloropyrimidin-4-yl)phenyl]methyl]morpholine;2,4-dichloropyrimidine;(4-formylphenyl)boronic acid;methyl 4-(aminomethyl)benzoate
CID 159499458

Frequently Asked Questions

What is the IUPAC name of (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate?
The IUPAC name of (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate (CID 163471993) is (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate.
What is the SMILES notation for (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate?
The canonical SMILES for (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate is COC(=O)c1cc(-c2cc(F)cc(Cl)c2)ncn1.COC(=O)c1cc(Cl)ncn1.COc1ncc(CC(=O)c2cc(-c3cc(F)cc(Cl)c3)ncn2)cn1.COc1ncc(N)cn1.Cn1cc(CC(=O)c2cc(-c3cc(F)cc(Cl)c3)ncn2)cnc1=O.O=C(Cc1cnc(=O)[nH]c1)c1cc(-c2cc(F)cc(Cl)c2)ncn1.O=C(O)c1cc(-c2cc(F)cc(Cl)c2)ncn1.OB(O)c1cc(F)cc(Cl)c1.
What is the InChIKey of (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate?
The InChIKey is BXGSQEARZDDNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H12ClFN4O2.C16H10ClFN4O2.C12H8ClFN2O2.C11H6ClFN2O2.C6H5BClFO2.C6H5ClN2O2.C5H7N3O/c1-23-8-10(7-20-17(23)25)2-16(24)15-6-14(21-9-22-15)11-3-12(18)5-13(19)4-11;1-25-17-20-7-10(8-21-17)2-16(24)15-6-14(22-9-23-15)11-3-12(18)5-13(19)4-11;17-11-2-10(3-12(18)4-11)13-5-14(22-8-21-13)15(23)1-9-6-19-16(24)20-7-9;1-18-12(17)11-5-10(15-6-16-11)7-2-8(13)4-9(14)3-7;12-7-1-6(2-8(13)3-7)9-4-10(11(16)17)15-5-14-9;8-5-1-4(7(10)11)2-6(9)3-5;1-11-6(10)4-2-5(7)9-3-8-4;1-9-5-7-2-4(6)3-8-5/h2*3-9H,2H2,1H3;2-8H,1H2,(H,19,20,24);2-6H,1H3;1-5H,(H,16,17);1-3,10-11H;2-3H,1H3;2-3H,6H2,1H3.
What are the key properties of (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate?
(3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate has a molecular weight of 2053.61 g/mol, XLogP of 14.56, 20 rotatable bonds, 5 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-5-fluorophenyl)boronic acid;6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylic acid;1-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-(2-methoxypyrimidin-5-yl)ethanone;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1-methylpyrimidin-2-one;5-[2-[6-(3-chloro-5-fluorophenyl)pyrimidin-4-yl]-2-oxoethyl]-1H-pyrimidin-2-one;2-methoxypyrimidin-5-amine;methyl 6-(3-chloro-5-fluorophenyl)pyrimidine-4-carboxylate;methyl 6-chloropyrimidine-4-carboxylate is sourced from PubChem (CID 163471993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).