5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione
TL;DR: 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione (CAS 3414-43-5) is a chemical compound with molecular formula C14H19NO2S and molecular weight 265.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-tert-butylphenoxy)methyl]-1,3-oxazolidine-2-thione
Also Known As: 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione, 2-Oxazolidinethione, 5-((m-tert-butylphenoxy)methyl)-, 5-[(3-tert-butylphenoxy)methyl]-1,3-oxazolidine-2-thione, 5-[(m-tert-Butylphenoxy)methyl]-2-oxazolidinethione, 5-[(3-tert-Butylphenoxy)methyl]-4,5-dihydro-1,3-oxazole-2-thiol
| Molecular Formula | C14H19NO2S |
|---|---|
| Molecular Weight | 265.11 g/mol |
| LogP | 2.6362 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.11365 |
| Heavy Atoms | 18 |
| Complexity | 439.66528 |
Chemical Identifiers
| CAS Number | 3414-43-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC=C1)OCC2CNC(=S)O2 |
Product Overview
5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione (CAS 3414-43-5), with molecular formula C14H19NO2S and molecular weight 265.11 g/mol. IUPAC: 5-[(3-tert-butylphenoxy)methyl]-1,3-oxazolidine-2-thione.
Chemical Property Profile of 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione
Property Insights of 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione
The XLogP value of 2.6362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione. With a topological polar surface area (TPSA) of 30.49 Ų, 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione has 1 hydrogen bond donor(s) and 3 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 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione?
The CAS number of 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione is 3414-43-5.
What is the molecular formula of 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione?
The molecular formula of 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione is C14H19NO2S.
What is the molecular weight of 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione?
The molecular weight of 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione is 265.11 g/mol.
Where can I buy 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione?
You can request a quote for 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione?
Yes, KEHONG BIO provides custom synthesis services for 5-((m-tert-Butylphenoxy)methyl)-2-oxazolidinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.