About 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 160870607) has the molecular formula C145H212B3Br5Cl2N8O24
and a molecular weight of 2954.18 g/mol. Its IUPAC name is 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.
Frequently Asked Questions
What is the IUPAC name of 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
The IUPAC name of 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 160870607) is 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.
What is the SMILES notation for 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
The canonical SMILES for 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is C=C(C)C[C@@]1(C(C)C)CCN([C@@H](C)c2ccc(Br)cc2)C(=O)O1.C=C(C)C[C@]1(C(C)C)CCN([C@@H](C)c2ccc(Br)cc2)C(=O)O1.CC(C)[C@@]1(CC(C)(C)O)CCN([C@@H](C)c2ccc(-c3ccn(C)c(=O)c3)cc2)C(=O)O1.CC(C)[C@@]1(CC(C)(C)O)CCN([C@@H](C)c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)C(=O)O1.CC(C)[C@@]1(CC(C)(C)O)CCN([C@@H](C)c2ccc(Br)cc2)C(=O)O1.CC(C)[C@@]1(CC2(C)CO2)CCN([C@@H](C)c2ccc(Br)cc2)C(=O)O1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.ClCCl.Cn1ccc(Br)cc1=O.
What is the InChIKey of 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
The InChIKey is SLRYYBKHWDVTJS-YSZBCQSYSA-N. The full InChI is InChI=1S/C25H40BNO5.C25H34N2O4.C19H26BrNO3.C19H28BrNO3.2C19H26BrNO2.C12H24B2O4.C6H6BrNO.CH2Cl2/c1-17(2)25(16-22(4,5)29)14-15-27(21(28)30-25)18(3)19-10-12-20(13-11-19)26-31-23(6,7)24(8,9)32-26;1-17(2)25(16-24(4,5)30)12-14-27(23(29)31-25)18(3)19-7-9-20(10-8-19)21-11-13-26(6)22(28)15-21;1-13(2)19(11-18(4)12-23-18)9-10-21(17(22)24-19)14(3)15-5-7-16(20)8-6-15;1-13(2)19(12-18(4,5)23)10-11-21(17(22)24-19)14(3)15-6-8-16(20)9-7-15;2*1-13(2)12-19(14(3)4)10-11-21(18(22)23-19)15(5)16-6-8-17(20)9-7-16;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-8-3-2-5(7)4-6(8)9;2-1-3/h10-13,17-18,29H,14-16H2,1-9H3;7-11,13,15,17-18,30H,12,14,16H2,1-6H3;5-8,13-14H,9-12H2,1-4H3;6-9,13-14,23H,10-12H2,1-5H3;2*6-9,14-15H,1,10-12H2,2-5H3;1-8H3;2-4H,1H3;1H2/t2*18-,25-;14-,18?,19-;14-,19-;15-,19+;15-,19-;;;/m000000.../s1.
What are the key properties of 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane has a molecular weight of 2954.18 g/mol, XLogP of 35.04, 33 rotatable bonds, 3 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-methylpyridin-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-[(2-methyloxiran-2-yl)methyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6R)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-3-[(1S)-1-(4-bromophenyl)ethyl]-6-(2-methylprop-2-enyl)-6-propan-2-yl-1,3-oxazinan-2-one;dichloromethane;(6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]ethyl]-6-propan-2-yl-1,3-oxazinan-2-one;(6S)-6-(2-hydroxy-2-methylpropyl)-6-propan-2-yl-3-[(1S)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethyl]-1,3-oxazinan-2-one;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 160870607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).