(4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane

C156H198F10N10O40 — CID 160735960

IUPAC(4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane
SMILESC.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC(C)(c2ccccc2)[C@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC(c2ccccc2)(c2ccccc2)[C@@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1C(C)(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1c1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1C(C)(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1Cc1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1c1ccccc1
InChIInChI=1S/C24H26FNO4.C19H24FNO4.2C16H18FNO4.2C15H16FNO4.2C13H20FNO4.2C12H18FNO4.CH4/c1-5-19(27)23(4,25)21(28)26-20(16(2)3)24(30-22(26)29,17-12-8-6-9-13-17)18-14-10-7-11-15-18;1-6-14(22)18(4,20)16(23)21-15(12(2)3)19(5,25-17(21)24)13-10-8-7-9-11-13;2*1-3-13(19)16(2,17)14(20)18-12(10-22-15(18)21)9-11-7-5-4-6-8-11;2*1-3-12(18)15(2,16)13(19)17-11(9-21-14(17)20)10-7-5-4-6-8-10;2*1-6-9(16)13(5,14)10(17)15-8(12(2,3)4)7-19-11(15)18;2*1-5-9(15)12(4,13)10(16)14-8(7(2)3)6-18-11(14)17;/h5-16,19-20,27H,1H2,2-4H3;6-12,14-15,22H,1H2,2-5H3;2*3-8,12-13,19H,1,9-10H2,2H3;2*3-8,11-12,18H,1,9H2,2H3;2*6,8-9,16H,1,7H2,2-5H3;2*5,7-9,15H,1,6H2,2-4H3;1H4/t19-,20+,23-;14-,15-,18-,19?;12-,13+,16+;12-,13-,16-;11-,12+,15+;11-,12-,15-;8-,9+,13+;8-,9-,13-;8-,9+,12+;8-,9-,12-;/m1101010101./s1
InChIKeyRUYHRCNHFFGCQG-KBDRBPTFSA-N
MW3043.31 g/mol
LogP21.53
Rot. Bonds43

About (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane

(4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane (PubChem CID 160735960) has the molecular formula C156H198F10N10O40 and a molecular weight of 3043.31 g/mol. Its IUPAC name is (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane.

Molecular Properties

Compound Name(4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane
PubChem CID160735960
Molecular FormulaC156H198F10N10O40
Molecular Weight3043.31 g/mol
Exact Mass3041.36
IUPAC Name(4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane
SMILESC.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC(C)(c2ccccc2)[C@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC(c2ccccc2)(c2ccccc2)[C@@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1C(C)(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1c1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1C(C)(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1Cc1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1c1ccccc1
InChIInChI=1S/C24H26FNO4.C19H24FNO4.2C16H18FNO4.2C15H16FNO4.2C13H20FNO4.2C12H18FNO4.CH4/c1-5-19(27)23(4,25)21(28)26-20(16(2)3)24(30-22(26)29,17-12-8-6-9-13-17)18-14-10-7-11-15-18;1-6-14(22)18(4,20)16(23)21-15(12(2)3)19(5,25-17(21)24)13-10-8-7-9-11-13;2*1-3-13(19)16(2,17)14(20)18-12(10-22-15(18)21)9-11-7-5-4-6-8-11;2*1-3-12(18)15(2,16)13(19)17-11(9-21-14(17)20)10-7-5-4-6-8-10;2*1-6-9(16)13(5,14)10(17)15-8(12(2,3)4)7-19-11(15)18;2*1-5-9(15)12(4,13)10(16)14-8(7(2)3)6-18-11(14)17;/h5-16,19-20,27H,1H2,2-4H3;6-12,14-15,22H,1H2,2-5H3;2*3-8,12-13,19H,1,9-10H2,2H3;2*3-8,11-12,18H,1,9H2,2H3;2*6,8-9,16H,1,7H2,2-5H3;2*5,7-9,15H,1,6H2,2-4H3;1H4/t19-,20+,23-;14-,15-,18-,19?;12-,13+,16+;12-,13-,16-;11-,12+,15+;11-,12-,15-;8-,9+,13+;8-,9-,13-;8-,9+,12+;8-,9-,12-;/m1101010101./s1
InChIKeyRUYHRCNHFFGCQG-KBDRBPTFSA-N
XLogP21.53
TPSA668.40 Ų
H-Bond Donors10
H-Bond Acceptors40
Rotatable Bonds43
Heavy Atoms216
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003043.31
LogP ≤ 521.53
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1040

Analyze (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane?
The IUPAC name of (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane (CID 160735960) is (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane.
What is the SMILES notation for (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane?
The canonical SMILES for (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane is C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC(C)(c2ccccc2)[C@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC(c2ccccc2)(c2ccccc2)[C@@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1C(C)(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@@H]1c1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1C(C)(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1C(C)C.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1Cc1ccccc1.C=C[C@@H](O)[C@@](C)(F)C(=O)N1C(=O)OC[C@H]1c1ccccc1.
What is the InChIKey of (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane?
The InChIKey is RUYHRCNHFFGCQG-KBDRBPTFSA-N. The full InChI is InChI=1S/C24H26FNO4.C19H24FNO4.2C16H18FNO4.2C15H16FNO4.2C13H20FNO4.2C12H18FNO4.CH4/c1-5-19(27)23(4,25)21(28)26-20(16(2)3)24(30-22(26)29,17-12-8-6-9-13-17)18-14-10-7-11-15-18;1-6-14(22)18(4,20)16(23)21-15(12(2)3)19(5,25-17(21)24)13-10-8-7-9-11-13;2*1-3-13(19)16(2,17)14(20)18-12(10-22-15(18)21)9-11-7-5-4-6-8-11;2*1-3-12(18)15(2,16)13(19)17-11(9-21-14(17)20)10-7-5-4-6-8-10;2*1-6-9(16)13(5,14)10(17)15-8(12(2,3)4)7-19-11(15)18;2*1-5-9(15)12(4,13)10(16)14-8(7(2)3)6-18-11(14)17;/h5-16,19-20,27H,1H2,2-4H3;6-12,14-15,22H,1H2,2-5H3;2*3-8,12-13,19H,1,9-10H2,2H3;2*3-8,11-12,18H,1,9H2,2H3;2*6,8-9,16H,1,7H2,2-5H3;2*5,7-9,15H,1,6H2,2-4H3;1H4/t19-,20+,23-;14-,15-,18-,19?;12-,13+,16+;12-,13-,16-;11-,12+,15+;11-,12-,15-;8-,9+,13+;8-,9-,13-;8-,9+,12+;8-,9-,12-;/m1101010101./s1.
What are the key properties of (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane?
(4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane has a molecular weight of 3043.31 g/mol, XLogP of 21.53, 43 rotatable bonds, 10 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-benzyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4R)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-4-tert-butyl-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5,5-diphenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-5-methyl-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-phenyl-1,3-oxazolidin-2-one;(4S)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;(4R)-3-[(2R,3R)-2-fluoro-3-hydroxy-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one;methane is sourced from PubChem (CID 160735960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).