magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide

C133H117Br4Cl5MgN14O20Zn — CID 158480240

About magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide

magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide (PubChem CID 158480240) has the molecular formula C133H117Br4Cl5MgN14O20Zn and a molecular weight of 2818.05 g/mol. Its IUPAC name is magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide.

Molecular Properties

• Compound Name: magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide
• PubChem CID: 158480240
• Molecular Formula: C133H117Br4Cl5MgN14O20Zn
• Molecular Weight: 2818.05 g/mol
• Exact Mass: 2808.29
• IUPAC Name: magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide
• SMILES: CN(C)C(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(Br)cc3)Oc3cc(Cl)cnc3[C@]2(O)C1(C)O.CN(C)C(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(C#N)cc3)Oc3cc(Cl)cnc3[C@]2(O)[C@@]1(C)O.CN(C)C(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(C#N)cc3)Oc3cc(Cl)cnc3[C@]2(O)[C@]1(C)O.CN(C)C(=O)[C@H]1C(=O)[C@@]2(O)c3ncc(Cl)cc3O[C@@]2(c2ccc(Br)cc2)[C@@H]1c1ccccc1.CN(C)C(=O)[C@H]1[C@@H](O)[C@@]2(O)c3ncc(Cl)cc3O[C@@]2(c2ccc(Br)cc2)[C@@H]1c1ccccc1.[Br-].[C-]#N.[C-]#N.[CH3-].[Mg+2].[Zn+2]
• InChI: InChI=1S/2C27H24ClN3O4.C26H24BrClN2O4.C25H22BrClN2O4.C25H20BrClN2O4.2CN.CH3.BrH.Mg.Zn/c2*1-25(33)22(24(32)31(2)3)21(17-7-5-4-6-8-17)26(18-11-9-16(14-29)10-12-18)27(25,34)23-20(35-26)13-19(28)15-30-23;1-24(32)21(23(31)30(2)3)20(15-7-5-4-6-8-15)25(16-9-11-17(27)12-10-16)26(24,33)22-19(34-25)13-18(28)14-29-22;2*1-29(2)23(31)19-20(14-6-4-3-5-7-14)25(15-8-10-16(26)11-9-15)24(32,22(19)30)21-18(33-25)12-17(27)13-28-21;2*1-2;;;;/h2*4-13,15,21-22,33-34H,1-3H3;4-14,20-21,32-33H,1-3H3;3-13,19-20,22,30,32H,1-2H3;3-13,19-20,32H,1-2H3;;;1H3;1H;;/q;;;;;3*-1;;2*+2/p-1/t21-,22+,25+,26+,27+;21-,22+,25-,26+,27+;20-,21+,24?,25+,26+;19-,20-,22-,24+,25+;19-,20-,24+,25+;;;;;;/m11111....../s1
• InChIKey: UKWDZJGTDYUOSG-OFFAWDDHSA-M
• XLogP: 16.04
• TPSA: 506.45 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 29
• Rotatable Bonds: 15
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2818.05
LogP ≤ 5	16.04
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide?

The IUPAC name of magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide (CID 158480240) is magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide.

What is the SMILES notation for magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide?

The canonical SMILES for magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide is CN(C)C(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(Br)cc3)Oc3cc(Cl)cnc3[C@]2(O)C1(C)O.CN(C)C(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(C#N)cc3)Oc3cc(Cl)cnc3[C@]2(O)[C@@]1(C)O.CN(C)C(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(C#N)cc3)Oc3cc(Cl)cnc3[C@]2(O)[C@]1(C)O.CN(C)C(=O)[C@H]1C(=O)[C@@]2(O)c3ncc(Cl)cc3O[C@@]2(c2ccc(Br)cc2)[C@@H]1c1ccccc1.CN(C)C(=O)[C@H]1[C@@H](O)[C@@]2(O)c3ncc(Cl)cc3O[C@@]2(c2ccc(Br)cc2)[C@@H]1c1ccccc1.[Br-].[C-]#N.[C-]#N.[CH3-].[Mg+2].[Zn+2].

What is the InChIKey of magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide?

The InChIKey is UKWDZJGTDYUOSG-OFFAWDDHSA-M. The full InChI is InChI=1S/2C27H24ClN3O4.C26H24BrClN2O4.C25H22BrClN2O4.C25H20BrClN2O4.2CN.CH3.BrH.Mg.Zn/c2*1-25(33)22(24(32)31(2)3)21(17-7-5-4-6-8-17)26(18-11-9-16(14-29)10-12-18)27(25,34)23-20(35-26)13-19(28)15-30-23;1-24(32)21(23(31)30(2)3)20(15-7-5-4-6-8-15)25(16-9-11-17(27)12-10-16)26(24,33)22-19(34-25)13-18(28)14-29-22;2*1-29(2)23(31)19-20(14-6-4-3-5-7-14)25(15-8-10-16(26)11-9-15)24(32,22(19)30)21-18(33-25)12-17(27)13-28-21;2*1-2;;;;/h2*4-13,15,21-22,33-34H,1-3H3;4-14,20-21,32-33H,1-3H3;3-13,19-20,22,30,32H,1-2H3;3-13,19-20,32H,1-2H3;;;1H3;1H;;/q;;;;;3*-1;;2*+2/p-1/t21-,22+,25+,26+,27+;21-,22+,25-,26+,27+;20-,21+,24?,25+,26+;19-,20-,22-,24+,25+;19-,20-,24+,25+;;;;;;/m11111....../s1.

What are the key properties of magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide?

magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide has a molecular weight of 2818.05 g/mol, XLogP of 16.04, 15 rotatable bonds, 9 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for magnesium;zinc;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N-dimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2R,4R,5S,6R)-6-(4-bromophenyl)-10-chloro-2-hydroxy-N,N-dimethyl-3-oxo-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;carbanide;(2S,3R,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;(2S,3S,4R,5S,6R)-10-chloro-6-(4-cyanophenyl)-2,3-dihydroxy-N,N,3-trimethyl-5-phenyl-7-oxa-12-azatricyclo[6.4.0.02,6]dodeca-1(8),9,11-triene-4-carboxamide;bromide;dicyanide is sourced from PubChem (CID 158480240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).