About tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one
tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one (PubChem CID 157454899) has the molecular formula C119H147F4IN18O24
and a molecular weight of 2416.48 g/mol. Its IUPAC name is tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one.
Frequently Asked Questions
What is the IUPAC name of tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one?
The IUPAC name of tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one (CID 157454899) is tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one is CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(N3C(=O)OC[C@H]3CO)c(F)c2)CC1.CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(N3C(=O)OC[C@H]3COC(=O)c3ccccc3)c(F)c2)CC1.COC[C@@H]1COC(=O)N1c1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1F.COC[C@@H]1COC(=O)N1c1ccc(C(=O)N2CCNCC2)cc1F.Cc1cc(C2CC2)cnc1N1CCNCC1.O=C(c1ccc(I)cc1)N1CCN(c2ncc(C3CC3)cc2C2CC2)CC1.
What is the InChIKey of tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one?
The InChIKey is BTFXEKHQSHJGCD-OLOSPCSLSA-N. The full InChI is InChI=1S/C27H30FN3O7.C22H24IN3O.C21H28FN3O6.C20H26FN3O6.C16H20FN3O4.C13H19N3/c1-27(2,3)38-25(34)30-13-11-29(12-14-30)23(32)19-9-10-22(21(28)15-19)31-20(17-37-26(31)35)16-36-24(33)18-7-5-4-6-8-18;23-19-7-5-17(6-8-19)22(27)26-11-9-25(10-12-26)21-20(16-3-4-16)13-18(14-24-21)15-1-2-15;1-21(2,3)31-19(27)24-9-7-23(8-10-24)18(26)14-5-6-17(16(22)11-14)25-15(12-29-4)13-30-20(25)28;1-20(2,3)30-18(27)23-8-6-22(7-9-23)17(26)13-4-5-16(15(21)10-13)24-14(11-25)12-29-19(24)28;1-23-9-12-10-24-16(22)20(12)14-3-2-11(8-13(14)17)15(21)19-6-4-18-5-7-19;1-10-8-12(11-2-3-11)9-15-13(10)16-6-4-14-5-7-16/h4-10,15,20H,11-14,16-17H2,1-3H3;5-8,13-16H,1-4,9-12H2;5-6,11,15H,7-10,12-13H2,1-4H3;4-5,10,14,25H,6-9,11-12H2,1-3H3;2-3,8,12,18H,4-7,9-10H2,1H3;8-9,11,14H,2-7H2,1H3/t20-;;15-;14-;12-;/m1.111./s1.
What are the key properties of tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one?
tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one has a molecular weight of 2416.48 g/mol, XLogP of 14.95, 22 rotatable bonds, 3 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-[4-[(4R)-4-(benzoyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-3-fluorobenzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-[3-fluoro-4-[(4R)-4-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoyl]piperazine-1-carboxylate;1-(5-cyclopropyl-3-methyl-2-pyridinyl)piperazine;[4-(3,5-dicyclopropyl-2-pyridinyl)piperazin-1-yl]-(4-iodophenyl)methanone;(4R)-3-[2-fluoro-4-(piperazine-1-carbonyl)phenyl]-4-(methoxymethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 157454899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).