TL;DR: AO-022/43453144 (CAS 1330750-52-1) is a chemical compound with molecular formula C19H27N3O3S and molecular weight 377.1773 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(1S,2R)-1-(5-benzylsulfanyl-1,3,4-oxadiazol-2-yl)-2-methylbutyl]carbamate
Also Known As: AO-022/43453144, tert-butyl N-[(1S,2R)-1-(5-benzylsulfanyl-1,3,4-oxadiazol-2-yl)-2-methylbutyl]carbamate, Carbamic acid, N-[(1S,2R)-2-methyl-1-[5-[(phenylmethyl)thio]-1,3,4-oxadiazol-2-yl]butyl]-, 1,1-dimethylethyl ester, tert-butyl 1-[5-(benzylsulfanyl)-1,3,4-oxadiazol-2-yl]-2-methylbutylcarbamate
| Molecular Formula | C19H27N3O3S |
| Molecular Weight | 377.1773 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 377.1773 Da |
| Heavy Atoms | 26 |
| Complexity | 438.0 |
| SMILES | CC[C@@H](C)[C@@H](C1=NN=C(O1)SCC2=CC=CC=C2)NC(=O)OC(C)(C)C |
| InChIKey | LEGNSJIDAPOLIC-HIFRSBDPSA-N |
The XLogP value of 4.3 indicates that AO-022/43453144 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453144. Following Lipinski's Rule of Five, AO-022/43453144 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AO-022/43453144 is 1330750-52-1.
The molecular formula of AO-022/43453144 is C19H27N3O3S.
The molecular weight of AO-022/43453144 is 377.1773 g/mol.
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