magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride

C93H95Br5ClF3K2MgN16O20 — CID 159972607

IUPACmagnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride
SMILESCC(=O)O.CCOC(=O)c1cc(C(F)(F)F)n(CC(=O)c2ccc(Br)cc2)n1.CCOC(=O)c1cc(C)[nH]n1.CCOC(=O)c1cc(C)nn1CC(=O)c1ccc(Br)cc1.COC(=O)c1ccc(-c2cn3nc(C)cc3c(=O)[nH]2)cc1.Cc1cc2c(=O)[nH]c(-c3ccc(Br)cc3)cn2n1.Cc1cc2c(=O)[nH]c(-c3ccc(C(C)(C)O)cc3)cn2n1.N.O=C(CBr)c1ccc(Br)cc1.O=CO[O-].[CH3-].[Cl-].[H-].[K+].[K+].[Mg+2]
InChIInChI=1S/C16H17N3O2.C15H12BrF3N2O3.C15H15BrN2O3.C15H13N3O3.C13H10BrN3O.C8H6Br2O.C7H10N2O2.C2H4O2.CH2O3.CH3.ClH.2K.Mg.H3N.H/c1-10-8-14-15(20)17-13(9-19(14)18-10)11-4-6-12(7-5-11)16(2,3)21;1-2-24-14(23)11-7-13(15(17,18)19)21(20-11)8-12(22)9-3-5-10(16)6-4-9;1-3-21-15(20)13-8-10(2)17-18(13)9-14(19)11-4-6-12(16)7-5-11;1-9-7-13-14(19)16-12(8-18(13)17-9)10-3-5-11(6-4-10)15(20)21-2;1-8-6-12-13(18)15-11(7-17(12)16-8)9-2-4-10(14)5-3-9;9-5-8(11)6-1-3-7(10)4-2-6;1-3-11-7(10)6-4-5(2)8-9-6;1-2(3)4;2-1-4-3;;;;;;;/h4-9,21H,1-3H3,(H,17,20);3-7H,2,8H2,1H3;4-8H,3,9H2,1-2H3;3-8H,1-2H3,(H,16,19);2-7H,1H3,(H,15,18);1-4H,5H2;4H,3H2,1-2H3,(H,8,9);1H3,(H,3,4);1,3H;1H3;1H;;;;1H3;/q;;;;;;;;;-1;;2*+1;+2;;-1/p-2
InChIKeyJNHFMFCTXXJPSB-UHFFFAOYSA-L
MW2351.34 g/mol
LogP7.31
Rot. Bonds20

About magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride

magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride (PubChem CID 159972607) has the molecular formula C93H95Br5ClF3K2MgN16O20 and a molecular weight of 2351.34 g/mol. Its IUPAC name is magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride.

Molecular Properties

Compound Namemagnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride
PubChem CID159972607
Molecular FormulaC93H95Br5ClF3K2MgN16O20
Molecular Weight2351.34 g/mol
Exact Mass2344.16
IUPAC Namemagnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride
SMILESCC(=O)O.CCOC(=O)c1cc(C(F)(F)F)n(CC(=O)c2ccc(Br)cc2)n1.CCOC(=O)c1cc(C)[nH]n1.CCOC(=O)c1cc(C)nn1CC(=O)c1ccc(Br)cc1.COC(=O)c1ccc(-c2cn3nc(C)cc3c(=O)[nH]2)cc1.Cc1cc2c(=O)[nH]c(-c3ccc(Br)cc3)cn2n1.Cc1cc2c(=O)[nH]c(-c3ccc(C(C)(C)O)cc3)cn2n1.N.O=C(CBr)c1ccc(Br)cc1.O=CO[O-].[CH3-].[Cl-].[H-].[K+].[K+].[Mg+2]
InChIInChI=1S/C16H17N3O2.C15H12BrF3N2O3.C15H15BrN2O3.C15H13N3O3.C13H10BrN3O.C8H6Br2O.C7H10N2O2.C2H4O2.CH2O3.CH3.ClH.2K.Mg.H3N.H/c1-10-8-14-15(20)17-13(9-19(14)18-10)11-4-6-12(7-5-11)16(2,3)21;1-2-24-14(23)11-7-13(15(17,18)19)21(20-11)8-12(22)9-3-5-10(16)6-4-9;1-3-21-15(20)13-8-10(2)17-18(13)9-14(19)11-4-6-12(16)7-5-11;1-9-7-13-14(19)16-12(8-18(13)17-9)10-3-5-11(6-4-10)15(20)21-2;1-8-6-12-13(18)15-11(7-17(12)16-8)9-2-4-10(14)5-3-9;9-5-8(11)6-1-3-7(10)4-2-6;1-3-11-7(10)6-4-5(2)8-9-6;1-2(3)4;2-1-4-3;;;;;;;/h4-9,21H,1-3H3,(H,17,20);3-7H,2,8H2,1H3;4-8H,3,9H2,1-2H3;3-8H,1-2H3,(H,16,19);2-7H,1H3,(H,15,18);1-4H,5H2;4H,3H2,1-2H3,(H,8,9);1H3,(H,3,4);1,3H;1H3;1H;;;;1H3;/q;;;;;;;;;-1;;2*+1;+2;;-1/p-2
InChIKeyJNHFMFCTXXJPSB-UHFFFAOYSA-L
XLogP7.31
TPSA513.10 Ų
H-Bond Donors7
H-Bond Acceptors31
Rotatable Bonds20
Heavy Atoms141
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002351.34
LogP ≤ 57.31
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride with MolForge

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Related Compounds

dipotassium;3-bromo-5-methyl-2,6-dihydropyrazolo[4,3-d]pyrimidin-7-one;3-bromo-5-methyl-1-[(2R)-1-phenylmethoxypropan-2-yl]-6H-pyrazolo[4,5-d]pyrimidin-7-one;[(2S)-2-bromopropoxy]methylbenzene;hydride;1-[(2R)-1-hydroxypropan-2-yl]-5-methyl-3-[1-(4-methylphenyl)ethyl]-6H-pyrazolo[4,5-d]pyrimidin-7-one;5-methyl-3-[1-(4-methylphenyl)ethenyl]-1-[(2R)-1-phenylmethoxypropan-2-yl]-6H-pyrazolo[4,5-d]pyrimidin-7-one;oxido formate;4,4,5,5-tetramethyl-2-[1-[4-(trifluoromethyl)phenyl]ethenyl]-1,3,2-dioxaborolane
CID 161113626
2-amino-N-(2,2,2-trifluoroethyl)acetamide;(1Z)-4-bromo-N-hydroxy-3-methylbenzenecarboximidoyl chloride;4-bromo-3-methylbenzaldehyde;(NE)-N-[(4-bromo-3-methylphenyl)methylidene]hydroxylamine;3-(4-bromo-3-methylphenyl)-5-methyl-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-4H-1,2-oxazole;4-[4-[5-(2,5-dimethylpyrazol-3-yl)-5-methyl-4H-1,2-oxazol-3-yl]-2-methylphenyl]-4-oxo-N-(2,2,2-trifluoroethyl)butanamide;1,3-dimethyl-5-(3,3,3-trifluoroprop-1-en-2-yl)pyrazole;methyl 2-methyl-4-[5-methyl-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-4H-1,2-oxazol-3-yl]benzoate;2-methyl-4-[5-methyl-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-4H-1,2-oxazol-3-yl]benzoic acid
CID 172973131
Magnesium;1-(4-bromophenyl)ethanone;2-[5-(4-bromophenyl)-1-(2-methylpropyl)pyrazol-3-yl]propan-2-ol;carbanide;ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate;ethyl 3-(4-bromophenyl)-1-(2-methylpropyl)pyrazole-5-carboxylate;bis(ethyl 5-(4-bromophenyl)-1-(2-methylpropyl)pyrazole-3-carboxylate);ethyl 2-oxopropanoate;methane;methanol;2-methylpropylhydrazine;bromide;hydrochloride
CID 158633338
dipotassium;sodium;acetic acid;azane;2-bromo-1-(4-tert-butylphenyl)ethanone;6-(4-tert-butylphenyl)-4-oxo-5H-pyrazolo[1,5-a]pyrazine-2-carboxylic acid;6-(4-tert-butylphenyl)-5H-pyrazolo[1,5-a]pyrazin-4-one;diethyl 1-[2-(4-tert-butylphenyl)-2-oxoethyl]pyrazole-3,5-dicarboxylate;diethyl 1H-pyrazole-3,5-dicarboxylate;ethyl 6-(4-tert-butylphenyl)-4-oxo-5H-pyrazolo[1,5-a]pyrazine-2-carboxylate;hydride;oxido formate;hydroxide
CID 158739339
dipotassium;acetic acid;azane;2-bromo-1-(4-tert-butylphenyl)ethanone;6-(4-tert-butylphenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;ethyl 1-[2-(4-tert-butylphenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 2-[2-(4-tert-butylphenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;oxido formate
CID 159613121
magnesium;6-(4-bromophenyl)-2-(hydroxymethyl)-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;2-(hydroxymethyl)-6-[4-(2-hydroxypropan-2-yl)phenyl]-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-[2-(hydroxymethyl)-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl]benzoate;chloride
CID 160440273
magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;3-(4-bromophenyl)-7-fluoro-2H-pyrrolo[1,2-a]pyrazin-1-one;carbanide;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-4-fluoropyrrole-2-carboxylate;ethyl 4-fluoro-1H-pyrrole-2-carboxylate;7-fluoro-3-[4-(2-hydroxypropan-2-yl)phenyl]-2H-pyrrolo[1,2-a]pyrazin-1-one;hydride;methyl 4-(7-fluoro-1-oxo-2H-pyrrolo[1,2-a]pyrazin-3-yl)benzoate;oxido formate;chloride
CID 161263668

Frequently Asked Questions

What is the IUPAC name of magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride?
The IUPAC name of magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride (CID 159972607) is magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride.
What is the SMILES notation for magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride?
The canonical SMILES for magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride is CC(=O)O.CCOC(=O)c1cc(C(F)(F)F)n(CC(=O)c2ccc(Br)cc2)n1.CCOC(=O)c1cc(C)[nH]n1.CCOC(=O)c1cc(C)nn1CC(=O)c1ccc(Br)cc1.COC(=O)c1ccc(-c2cn3nc(C)cc3c(=O)[nH]2)cc1.Cc1cc2c(=O)[nH]c(-c3ccc(Br)cc3)cn2n1.Cc1cc2c(=O)[nH]c(-c3ccc(C(C)(C)O)cc3)cn2n1.N.O=C(CBr)c1ccc(Br)cc1.O=CO[O-].[CH3-].[Cl-].[H-].[K+].[K+].[Mg+2].
What is the InChIKey of magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride?
The InChIKey is JNHFMFCTXXJPSB-UHFFFAOYSA-L. The full InChI is InChI=1S/C16H17N3O2.C15H12BrF3N2O3.C15H15BrN2O3.C15H13N3O3.C13H10BrN3O.C8H6Br2O.C7H10N2O2.C2H4O2.CH2O3.CH3.ClH.2K.Mg.H3N.H/c1-10-8-14-15(20)17-13(9-19(14)18-10)11-4-6-12(7-5-11)16(2,3)21;1-2-24-14(23)11-7-13(15(17,18)19)21(20-11)8-12(22)9-3-5-10(16)6-4-9;1-3-21-15(20)13-8-10(2)17-18(13)9-14(19)11-4-6-12(16)7-5-11;1-9-7-13-14(19)16-12(8-18(13)17-9)10-3-5-11(6-4-10)15(20)21-2;1-8-6-12-13(18)15-11(7-17(12)16-8)9-2-4-10(14)5-3-9;9-5-8(11)6-1-3-7(10)4-2-6;1-3-11-7(10)6-4-5(2)8-9-6;1-2(3)4;2-1-4-3;;;;;;;/h4-9,21H,1-3H3,(H,17,20);3-7H,2,8H2,1H3;4-8H,3,9H2,1-2H3;3-8H,1-2H3,(H,16,19);2-7H,1H3,(H,15,18);1-4H,5H2;4H,3H2,1-2H3,(H,8,9);1H3,(H,3,4);1,3H;1H3;1H;;;;1H3;/q;;;;;;;;;-1;;2*+1;+2;;-1/p-2.
What are the key properties of magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride?
magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride has a molecular weight of 2351.34 g/mol, XLogP of 7.31, 20 rotatable bonds, 7 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;dipotassium;acetic acid;azane;2-bromo-1-(4-bromophenyl)ethanone;6-(4-bromophenyl)-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;carbanide;ethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate;ethyl 1-[2-(4-bromophenyl)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-3-carboxylate;ethyl 5-methyl-1H-pyrazole-3-carboxylate;hydride;6-[4-(2-hydroxypropan-2-yl)phenyl]-2-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one;methyl 4-(2-methyl-4-oxo-5H-pyrazolo[1,5-a]pyrazin-6-yl)benzoate;oxido formate;chloride is sourced from PubChem (CID 159972607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).