AC1LDDNQ
tert-butyl (2S)-2-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate
Also Known As: tert-butyl (2S)-2-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate|(2S)-2-[5-[(2,4-dichlorophenyl)methylthio]-1,3,4-oxadiazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester|tert-butyl (2S)-2-{5-[(2,4-dichlorobenzyl)thio]-1,3,4-oxadiazol-2-yl}pyrrolidine-1-carboxylate|tert-butyl (2S)-2-{5-[(2,4-dichlorophenyl)methylthio](1,3,4-oxadiazol-2-yl)}py rrolidinecarboxylate|TERT-BUTYL 2-(5-{[(2,4-DICHLOROPHENYL)METHYL]SULFANYL}-1,3,4-OXADIAZOL-2-YL)PYRROLIDINE-1-CARBOXYLATE
| Molecular Formula | C18H21Cl2N3O3S |
|---|---|
| Molecular Weight | 429.06805 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.06805 |
| Monoisotopic Mass | 429.06805 |
| Heavy Atoms | 27 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 1164528-68-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC[C@H]1C2=NN=C(O2)SCC3=C(C=C(C=C3)Cl)Cl |
| InChIKey | JDZKHMFWSIVDHP-AWEZNQCLSA-N |
Product Overview
AC1LDDNQ (CAS 1164528-68-0), with molecular formula C18H21Cl2N3O3S and molecular weight 429.06805 g/mol. IUPAC: tert-butyl (2S)-2-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate.
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