AC1MXBJL
tert-butyl N-[5-[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]pentyl]carbamate
Also Known As: tert-butyl (5-(5-((2-(4-chlorophenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pentyl)carbamate|tert-butyl [5-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pentyl]carbamate|Tert-butyl N-[5-[5-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]pentyl]carbamate|tert-butyl N-[5-[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]pentyl]carbamate
| Molecular Formula | C20H26ClN3O4S |
|---|---|
| Molecular Weight | 439.13327 g/mol |
| LogP | 4.9355 |
| Topological Polar Surface Area | 94.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 439.13327 |
| Monoisotopic Mass | 439.13327 |
| Heavy Atoms | 29 |
| Complexity | 802.8028 |
Chemical Identifiers
| CAS Number | 877802-61-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCCCCC1=NN=C(O1)SCC(=O)C2=CC=C(C=C2)Cl |
Product Overview
AC1MXBJL (CAS 877802-61-4), with molecular formula C20H26ClN3O4S and molecular weight 439.13327 g/mol. IUPAC: tert-butyl N-[5-[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]pentyl]carbamate.
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