tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
TL;DR: tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate (CAS 1164524-28-0) is a chemical compound with molecular formula C13H23N3O3S and molecular weight 301.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
Also Known As: tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate, (S)-tert-butyl (1-(5-(butylthio)-1,3,4-oxadiazol-2-yl)ethyl)carbamate, N-[(1S)-1-(5-butylthio(1,3,4-oxadiazol-2-yl))ethyl](tert-butoxy)carboxamide, N-[(1S)-1-[5-(butylthio)-1,3,4-oxadiazol-2-yl]ethyl]carbamic acid tert-butyl ester, tert-butyl {(1S)-1-[5-(butylsulfanyl)-1,3,4-oxadiazol-2-yl]ethyl}carbamate
| Molecular Formula | C13H23N3O3S |
|---|---|
| Molecular Weight | 301.15 g/mol |
| LogP | 3.5475 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.14603 |
| Heavy Atoms | 20 |
| Complexity | 428.74103 |
Chemical Identifiers
| CAS Number | 1164524-28-0 |
|---|---|
| SMILES | CCCCSC1=NN=C(O1)[C@H](C)NC(=O)OC(C)(C)C |
Product Overview
tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate (CAS 1164524-28-0), with molecular formula C13H23N3O3S and molecular weight 301.15 g/mol. IUPAC: tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate.
Chemical Property Profile of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
Property Insights of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
The XLogP value of 3.5475 indicates that tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.25 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
The CAS number of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate is 1164524-28-0.
What is the molecular formula of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
The molecular formula of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate is C13H23N3O3S.
What is the molecular weight of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
The molecular weight of tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate is 301.15 g/mol.
Where can I buy tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
You can request a quote for tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[(1S)-1-(5-butylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.