1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)
TL;DR: 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) (CAS 54266-75-0) is a chemical compound with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-(5-methyl-1,3-oxathiolan-4-ylidene)amino] N-phenylcarbamate
Also Known As: 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)
| Molecular Formula | C11H12N2O3S |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 2.658 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.05687 |
| Heavy Atoms | 17 |
| Complexity | 421.98453 |
Chemical Identifiers
| CAS Number | 54266-75-0 |
|---|---|
| SMILES | CC1/C(=N/OC(=O)NC2=CC=CC=C2)/SCO1 |
Product Overview
1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) (CAS 54266-75-0), with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol. IUPAC: [(Z)-(5-methyl-1,3-oxathiolan-4-ylidene)amino] N-phenylcarbamate.
Chemical Property Profile of 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)
Property Insights of 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)
The XLogP value of 2.658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z). With a topological polar surface area (TPSA) of 59.92 Ų, 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) has 1 hydrogen bond donor(s) and 5 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 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)?
The CAS number of 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) is 54266-75-0.
What is the molecular formula of 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)?
The molecular formula of 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) is C11H12N2O3S.
What is the molecular weight of 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)?
The molecular weight of 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) is 252.06 g/mol.
Where can I buy 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)?
You can request a quote for 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z)?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Oxathiolan-4-one, 5-methyl-, O-((phenylamino)carbonyl)oxime, (Z) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.