About dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide
dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide (PubChem CID 159899741) has the molecular formula C131H130Br4F12Mg2N18O39
and a molecular weight of 3176.77 g/mol. Its IUPAC name is dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide.
Frequently Asked Questions
What is the IUPAC name of dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide?
The IUPAC name of dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide (CID 159899741) is dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide.
What is the SMILES notation for dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide?
The canonical SMILES for dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide is COC(=O)c1c(OC)c(=O)c(C(=O)NCc2ccc(F)cc2F)cn1CC(O)O.COc1c2n(cc(C(=O)NCc3ccc(F)cc3F)c1=O)C[C@@H]1OC3COCC(C3)N1C2=O.COc1c2n(cc(C(=O)NCc3ccc(F)cc3F)c1=O)C[C@@H]1O[C@H]3COC[C@H](C3)N1C2=O.COc1c2n(cc(C(=O)NCc3ccc(F)cc3F)c1=O)C[C@H]1O[C@@H]3COC[C@@H](C3)N1C2=O.N[C@H]1COC[C@@H](O)C1.O=C(NCc1ccc(F)cc1F)c1cn2c(c(O)c1=O)C(=O)N1[C@@H]3COC[C@@H](C3)O[C@H]1C2.O=C(NCc1ccc(F)cc1F)c1cn2c(c(O)c1=O)C(=O)N1[C@H]3COC[C@H](C3)O[C@@H]1C2.[Br-].[Br-].[Br-].[Br-].[Mg+2].[Mg+2].
What is the InChIKey of dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide?
The InChIKey is NVULKYLOVXOAPW-PBOYSBIDSA-J. The full InChI is InChI=1S/3C22H21F2N3O6.2C21H19F2N3O6.C18H18F2N2O7.C5H11NO2.4BrH.2Mg/c3*1-31-20-18-22(30)27-13-5-14(10-32-9-13)33-17(27)8-26(18)7-15(19(20)28)21(29)25-6-11-2-3-12(23)4-16(11)24;2*22-11-2-1-10(15(23)3-11)5-24-20(29)14-6-25-7-16-26(12-4-13(32-16)9-31-8-12)21(30)17(25)19(28)18(14)27;1-28-16-14(18(27)29-2)22(8-13(23)24)7-11(15(16)25)17(26)21-6-9-3-4-10(19)5-12(9)20;6-4-1-5(7)3-8-2-4;;;;;;/h3*2-4,7,13-14,17H,5-6,8-10H2,1H3,(H,25,29);2*1-3,6,12-13,16,28H,4-5,7-9H2,(H,24,29);3-5,7,13,23-24H,6,8H2,1-2H3,(H,21,26);4-5,7H,1-3,6H2;4*1H;;/q;;;;;;;;;;;2*+2/p-4/t13?,14?,17-;2*13-,14+,17-;2*12-,13+,16-;;4-,5+;;;;;;/m01010.1....../s1.
What are the key properties of dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide?
dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide has a molecular weight of 3176.77 g/mol, XLogP of -8.92, 25 rotatable bonds, 12 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for dimagnesium;(3S,5R)-5-aminooxan-3-ol;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1R,11R,13S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(1S,11S,13R)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;(11S)-N-[(2,4-difluorophenyl)methyl]-5-methoxy-3,6-dioxo-12,15-dioxa-2,9-diazatetracyclo[11.3.1.02,11.04,9]heptadeca-4,7-diene-7-carboxamide;methyl 5-[(2,4-difluorophenyl)methylcarbamoyl]-1-(2,2-dihydroxyethyl)-3-methoxy-4-oxopyridine-2-carboxylate;tetrabromide is sourced from PubChem (CID 159899741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).