![((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester structure](/static/products/116/1164526-42-4.png)
((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester
TL;DR: ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester (CAS 1164526-42-4) is a chemical compound with molecular formula C23H24ClN3O4S and molecular weight 473.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(1S)-1-[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-2-phenylethyl]carbamate
Also Known As: ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester, (S)-tert-butyl (1-(5-((2-(4-chlorophenyl)-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)-2-phenylethyl)carbamate, tert-butyl [(1S)-1-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl)-2-phenylethyl]carbamate, tert-butyl N-[(1S)-1-[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-2-phenylethyl]carbamate
| Molecular Formula | C23H24ClN3O4S |
|---|---|
| Molecular Weight | 473.12 g/mol |
| LogP | 5.5065 |
| Topological Polar Surface Area | 94.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 473.1176 |
| Heavy Atoms | 32 |
| Complexity | 1049.1084 |
Chemical Identifiers
| CAS Number | 1164526-42-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C2=NN=C(O2)SCC(=O)C3=CC=C(C=C3)Cl |
Product Overview
((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester (CAS 1164526-42-4), with molecular formula C23H24ClN3O4S and molecular weight 473.12 g/mol. IUPAC: tert-butyl N-[(1S)-1-[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-2-phenylethyl]carbamate.
Chemical Property Profile of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester
Property Insights of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester
The XLogP value of 5.5065 indicates that ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.32 Ų falls within the moderate polarity range, balancing permeability and solubility for ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester. Following Lipinski's Rule of Five, ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester?
The CAS number of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester is 1164526-42-4.
What is the molecular formula of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester?
The molecular formula of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester is C23H24ClN3O4S.
What is the molecular weight of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester?
The molecular weight of ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester is 473.12 g/mol.
Where can I buy ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester?
You can request a quote for ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester?
Yes, KEHONG BIO provides custom synthesis services for ((S)-1-{5-[2-(4-Chloro-phenyl)-2-oxo-ethylsulfanyl]-[1,3,4]oxadiazol-2-yl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.