magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride

C136H187BrCl2F10MgN16O20S — CID 165065342

About magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride

magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride (PubChem CID 165065342) has the molecular formula C136H187BrCl2F10MgN16O20S and a molecular weight of 2765.26 g/mol. Its IUPAC name is magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride.

Molecular Properties

• Compound Name: magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride
• PubChem CID: 165065342
• Molecular Formula: C136H187BrCl2F10MgN16O20S
• Molecular Weight: 2765.26 g/mol
• Exact Mass: 2761.22
• IUPAC Name: magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride
• SMILES: CC(C)(O)c1cc2[nH]ncc2cc1NC(=O)c1cccc(C(C)(F)F)n1.CC(C)(O)c1cc2[nH]ncc2cc1NC(=O)c1cccc(C(C)(F)F)n1.CC1(O)CCC(n2cc3cc(NC(=O)c4cccc(C(C)(F)F)n4)c(C(C)(C)O)cc3n2)CC1.CC1(O)CCC(n2cc3cc(NC(=O)c4cccc(C(C)(F)F)n4)c(C(C)(C)O)cc3n2)CC1.CC1CCC(=O)CC1.CC1CCC(C)(O)CC1.CC1CCC(C)(O)CC1.CC1CCC2(CC1)OCCO2.Cc1ccc(S(=O)(=O)Cl)cc1.Cl.OC1CCC2(CC1)OCCO2.[2H]CF.[2H]CF.[Br-].[CH3-].[Mg+2]
• InChI: InChI=1S/2C25H30F2N4O3.2C18H18F2N4O2.C9H16O2.C8H14O3.2C8H16O.C7H7ClO2S.C7H12O.2CH3F.CH3.BrH.ClH.Mg/c2*1-23(2,33)17-13-19-15(14-31(30-19)16-8-10-24(3,34)11-9-16)12-20(17)29-22(32)18-6-5-7-21(28-18)25(4,26)27;2*1-17(2,26)11-8-13-10(9-21-24-13)7-14(11)23-16(25)12-5-4-6-15(22-12)18(3,19)20;1-8-2-4-9(5-3-8)10-6-7-11-9;9-7-1-3-8(4-2-7)10-5-6-11-8;2*1-7-3-5-8(2,9)6-4-7;1-6-2-4-7(5-3-6)11(8,9)10;1-6-2-4-7(8)5-3-6;2*1-2;;;;/h2*5-7,12-14,16,33-34H,8-11H2,1-4H3,(H,29,32);2*4-9,26H,1-3H3,(H,21,24)(H,23,25);8H,2-7H2,1H3;7,9H,1-6H2;2*7,9H,3-6H2,1-2H3;2-5H,1H3;6H,2-5H2,1H3;2*1H3;1H3;2*1H;/q;;;;;;;;;;;;-1;;;+2/p-1/i;;;;;;;;;;2*1D
• InChIKey: DWRCVAIZVHUFRL-MMSYHLCRSA-M
• XLogP: 25.73
• TPSA: 531.16 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 30
• Rotatable Bonds: 19
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2765.26
LogP ≤ 5	25.73
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride?

The IUPAC name of magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride (CID 165065342) is magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride.

What is the SMILES notation for magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride?

The canonical SMILES for magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride is CC(C)(O)c1cc2[nH]ncc2cc1NC(=O)c1cccc(C(C)(F)F)n1.CC(C)(O)c1cc2[nH]ncc2cc1NC(=O)c1cccc(C(C)(F)F)n1.CC1(O)CCC(n2cc3cc(NC(=O)c4cccc(C(C)(F)F)n4)c(C(C)(C)O)cc3n2)CC1.CC1(O)CCC(n2cc3cc(NC(=O)c4cccc(C(C)(F)F)n4)c(C(C)(C)O)cc3n2)CC1.CC1CCC(=O)CC1.CC1CCC(C)(O)CC1.CC1CCC(C)(O)CC1.CC1CCC2(CC1)OCCO2.Cc1ccc(S(=O)(=O)Cl)cc1.Cl.OC1CCC2(CC1)OCCO2.[2H]CF.[2H]CF.[Br-].[CH3-].[Mg+2].

What is the InChIKey of magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride?

The InChIKey is DWRCVAIZVHUFRL-MMSYHLCRSA-M. The full InChI is InChI=1S/2C25H30F2N4O3.2C18H18F2N4O2.C9H16O2.C8H14O3.2C8H16O.C7H7ClO2S.C7H12O.2CH3F.CH3.BrH.ClH.Mg/c2*1-23(2,33)17-13-19-15(14-31(30-19)16-8-10-24(3,34)11-9-16)12-20(17)29-22(32)18-6-5-7-21(28-18)25(4,26)27;2*1-17(2,26)11-8-13-10(9-21-24-13)7-14(11)23-16(25)12-5-4-6-15(22-12)18(3,19)20;1-8-2-4-9(5-3-8)10-6-7-11-9;9-7-1-3-8(4-2-7)10-5-6-11-8;2*1-7-3-5-8(2,9)6-4-7;1-6-2-4-7(5-3-6)11(8,9)10;1-6-2-4-7(8)5-3-6;2*1-2;;;;/h2*5-7,12-14,16,33-34H,8-11H2,1-4H3,(H,29,32);2*4-9,26H,1-3H3,(H,21,24)(H,23,25);8H,2-7H2,1H3;7,9H,1-6H2;2*7,9H,3-6H2,1-2H3;2-5H,1H3;6H,2-5H2,1H3;2*1H3;1H3;2*1H;/q;;;;;;;;;;;;-1;;;+2/p-1/i;;;;;;;;;;2*1D;;;;.

What are the key properties of magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride?

magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride has a molecular weight of 2765.26 g/mol, XLogP of 25.73, 19 rotatable bonds, 15 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for magnesium;carbanide;deuterio(fluoro)methane;bis(6-(1,1-difluoroethyl)-N-[2-(4-hydroxy-4-methylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide);bis(6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide);bis(1,4-dimethylcyclohexan-1-ol);1,4-dioxaspiro[4.5]decan-8-ol;4-methylbenzenesulfonyl chloride;4-methylcyclohexan-1-one;8-methyl-1,4-dioxaspiro[4.5]decane;bromide;hydrochloride is sourced from PubChem (CID 165065342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).