(2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)

C172H272N46O44S3 — CID 159560946

About (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)

(2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium) (PubChem CID 159560946) has the molecular formula C172H272N46O44S3 and a molecular weight of 3784.55 g/mol. Its IUPAC name is (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium).

Molecular Properties

• Compound Name: (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)
• PubChem CID: 159560946
• Molecular Formula: C172H272N46O44S3
• Molecular Weight: 3784.55 g/mol
• Exact Mass: 3781.96
• IUPAC Name: (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)
• SMILES: C=C(NC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3O)o1)NC(=O)OC(C)(C)C.C=C(NC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)o1)NC(=O)OC(C)(C)C.C=C(NC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OS(=O)(=O)[O-])o1)NC(=O)OC(C)(C)C.C=C(NC[C@@H](O)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OS(=O)(=O)[O-])o1)NC(=O)OC(C)(C)C.CC(C)(C)OC(=O)N=C(NC(=O)OC(C)(C)C)n1cccn1.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)o1.C[C@H](CN)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)o1.NC(N)=NC[C@@H](O)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OS(=O)(=O)O)o1
• InChI: InChI=1S/C25H34N6O5.C19H24N4O3.C18H28N6O8S.C18H28N6O5.C18H23N5O3.C17H26N6O9S.2C16H36N.C14H22N4O4.C11H17N7O7S/c1-16(13-26-17(2)27-23(32)36-25(3,4)5)21-28-29-22(35-21)20-12-11-19-14-30(20)24(33)31(19)34-15-18-9-7-6-8-10-18;1-3-13(2)17-20-21-18(26-17)16-10-9-15-11-22(16)19(24)23(15)25-12-14-7-5-4-6-8-14;1-10(8-19-11(2)20-16(25)31-18(3,4)5)14-21-22-15(30-14)13-7-6-12-9-23(13)17(26)24(12)32-33(27,28)29;1-10(8-19-11(2)20-16(25)29-18(3,4)5)14-21-22-15(28-14)13-7-6-12-9-23(13)17(26)24(12)27;1-12(9-19)16-20-21-17(26-16)15-8-7-14-10-22(15)18(24)23(14)25-11-13-5-3-2-4-6-13;1-9(19-15(25)31-17(2,3)4)18-7-12(24)14-21-20-13(30-14)11-6-5-10-8-22(11)16(26)23(10)32-33(27,28)29;2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-13(2,3)21-11(19)16-10(18-9-7-8-15-18)17-12(20)22-14(4,5)6;12-10(13)14-3-7(19)9-16-15-8(24-9)6-2-1-5-4-17(6)11(20)18(5)25-26(21,22)23/h6-10,16,19-20,26H,2,11-15H2,1,3-5H3,(H,27,32);4-8,13,15-16H,3,9-12H2,1-2H3;10,12-13,19H,2,6-9H2,1,3-5H3,(H,20,25)(H,27,28,29);10,12-13,19,27H,2,6-9H2,1,3-5H3,(H,20,25);2-6,12,14-15H,7-11,19H2,1H3;10-12,18,24H,1,5-8H2,2-4H3,(H,19,25)(H,27,28,29);2*5-16H2,1-4H3;7-9H,1-6H3,(H,16,17,19,20);5-7,19H,1-4H2,(H4,12,13,14)(H,21,22,23)/q;;;;;;2*+1;;/p-2/t16-,19-,20+;13-,15-,16+;2*10-,12-,13+;12-,14-,15+;10-,11+,12-;;;;5-,6+,7-/m111111...1/s1
• InChIKey: XJTMXNFDKVTCTQ-HIXICOKTSA-L
• XLogP: 23.50
• TPSA: 1108.80 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 65
• Rotatable Bonds: 73
• Heavy Atoms: 265
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3784.55
LogP ≤ 5	23.50
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	65

Frequently Asked Questions

What is the IUPAC name of (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)?

The IUPAC name of (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium) (CID 159560946) is (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium).

What is the SMILES notation for (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)?

The canonical SMILES for (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium) is C=C(NC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3O)o1)NC(=O)OC(C)(C)C.C=C(NC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)o1)NC(=O)OC(C)(C)C.C=C(NC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OS(=O)(=O)[O-])o1)NC(=O)OC(C)(C)C.C=C(NC[C@@H](O)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OS(=O)(=O)[O-])o1)NC(=O)OC(C)(C)C.CC(C)(C)OC(=O)N=C(NC(=O)OC(C)(C)C)n1cccn1.CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.CC[C@@H](C)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)o1.C[C@H](CN)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)o1.NC(N)=NC[C@@H](O)c1nnc([C@@H]2CC[C@@H]3CN2C(=O)N3OS(=O)(=O)O)o1.

What is the InChIKey of (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)?

The InChIKey is XJTMXNFDKVTCTQ-HIXICOKTSA-L. The full InChI is InChI=1S/C25H34N6O5.C19H24N4O3.C18H28N6O8S.C18H28N6O5.C18H23N5O3.C17H26N6O9S.2C16H36N.C14H22N4O4.C11H17N7O7S/c1-16(13-26-17(2)27-23(32)36-25(3,4)5)21-28-29-22(35-21)20-12-11-19-14-30(20)24(33)31(19)34-15-18-9-7-6-8-10-18;1-3-13(2)17-20-21-18(26-17)16-10-9-15-11-22(16)19(24)23(15)25-12-14-7-5-4-6-8-14;1-10(8-19-11(2)20-16(25)31-18(3,4)5)14-21-22-15(30-14)13-7-6-12-9-23(13)17(26)24(12)32-33(27,28)29;1-10(8-19-11(2)20-16(25)29-18(3,4)5)14-21-22-15(28-14)13-7-6-12-9-23(13)17(26)24(12)27;1-12(9-19)16-20-21-17(26-16)15-8-7-14-10-22(15)18(24)23(14)25-11-13-5-3-2-4-6-13;1-9(19-15(25)31-17(2,3)4)18-7-12(24)14-21-20-13(30-14)11-6-5-10-8-22(11)16(26)23(10)32-33(27,28)29;2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-13(2,3)21-11(19)16-10(18-9-7-8-15-18)17-12(20)22-14(4,5)6;12-10(13)14-3-7(19)9-16-15-8(24-9)6-2-1-5-4-17(6)11(20)18(5)25-26(21,22)23/h6-10,16,19-20,26H,2,11-15H2,1,3-5H3,(H,27,32);4-8,13,15-16H,3,9-12H2,1-2H3;10,12-13,19H,2,6-9H2,1,3-5H3,(H,20,25)(H,27,28,29);10,12-13,19,27H,2,6-9H2,1,3-5H3,(H,20,25);2-6,12,14-15H,7-11,19H2,1H3;10-12,18,24H,1,5-8H2,2-4H3,(H,19,25)(H,27,28,29);2*5-16H2,1-4H3;7-9H,1-6H3,(H,16,17,19,20);5-7,19H,1-4H2,(H4,12,13,14)(H,21,22,23)/q;;;;;;2*+1;;/p-2/t16-,19-,20+;13-,15-,16+;2*10-,12-,13+;12-,14-,15+;10-,11+,12-;;;;5-,6+,7-/m111111...1/s1.

What are the key properties of (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium)?

(2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium) has a molecular weight of 3784.55 g/mol, XLogP of 23.50, 73 rotatable bonds, 16 hydrogen bond donors, and 65 hydrogen bond acceptors.

Where does this data come from?

All data for (2S,5R)-2-[5-[(2R)-1-aminopropan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;(2S,5R)-2-[5-[(2R)-butan-2-yl]-1,3,4-oxadiazol-2-yl]-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-7-one;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate;tert-butyl N-[1-[[(2R)-2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]propyl]amino]ethenyl]carbamate;[(2S,5R)-2-[5-[(1R)-2-(diaminomethylideneamino)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;[(2S,5R)-2-[5-[(1R)-1-hydroxy-2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]ethyl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;[(2S,5R)-2-[5-[(2R)-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethenylamino]propan-2-yl]-1,3,4-oxadiazol-2-yl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] sulfate;bis(tetrabutylazanium) is sourced from PubChem (CID 159560946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).