(S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate
TL;DR: (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate (CAS 1173684-46-2) is a chemical compound with molecular formula C18H23Cl2N3O5S and molecular weight 463.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(1S)-1-[5-[(2,6-dichlorophenyl)methylsulfonyl]-1,3,4-oxadiazol-2-yl]-2-methylpropyl]carbamate
Also Known As: (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate, tert-butyl N-[(1S)-1-[5-[(2,6-dichlorophenyl)methylsulfonyl]-1,3,4-oxadiazol-2-yl]-2-methylpropyl]carbamate
| Molecular Formula | C18H23Cl2N3O5S |
|---|---|
| Molecular Weight | 463.07 g/mol |
| LogP | 4.5721 |
| Topological Polar Surface Area | 111.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.07355 |
| Heavy Atoms | 29 |
| Complexity | 963.37305 |
Chemical Identifiers
| CAS Number | 1173684-46-2 |
|---|---|
| SMILES | CC(C)[C@@H](C1=NN=C(O1)S(=O)(=O)CC2=C(C=CC=C2Cl)Cl)NC(=O)OC(C)(C)C |
Product Overview
(S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate (CAS 1173684-46-2), with molecular formula C18H23Cl2N3O5S and molecular weight 463.07 g/mol. IUPAC: tert-butyl N-[(1S)-1-[5-[(2,6-dichlorophenyl)methylsulfonyl]-1,3,4-oxadiazol-2-yl]-2-methylpropyl]carbamate.
Chemical Property Profile of (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate
Property Insights of (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate
The XLogP value of 4.5721 indicates that (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.39 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate. Following Lipinski's Rule of Five, (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate has 1 hydrogen bond donor(s) and 7 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 (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate?
The CAS number of (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate is 1173684-46-2.
What is the molecular formula of (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate?
The molecular formula of (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate is C18H23Cl2N3O5S.
What is the molecular weight of (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate?
The molecular weight of (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate is 463.07 g/mol.
Where can I buy (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate?
You can request a quote for (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for (S)-tert-butyl (1-(5-((2,6-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylpropyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.