4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione
TL;DR: 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione (CAS 339097-17-5) is a chemical compound with molecular formula C11H10BrNO3S and molecular weight 314.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione
Also Known As: 8H-304S, 4-(4-bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione, 4-(4-bromophenyl)-2-methyl-1lambda~4~,4-thiazinane-1,3,5-trione, 4-(4-bromophenyl)-2-methyl-1lambda4-thiomorpholine-1,3,5-trione, 4-(4-Bromophenyl)-2-methyl-4-thiazinane-1,3,5-trione
| Molecular Formula | C11H10BrNO3S |
|---|---|
| Molecular Weight | 314.96 g/mol |
| LogP | 1.4595 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.95648 |
| Heavy Atoms | 17 |
| Complexity | 499.94293 |
Chemical Identifiers
| CAS Number | 339097-17-5 |
|---|---|
| SMILES | CC1C(=O)N(C(=O)CS1=O)C2=CC=C(C=C2)Br |
Product Overview
4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione (CAS 339097-17-5), with molecular formula C11H10BrNO3S and molecular weight 314.96 g/mol. IUPAC: 4-(4-bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione.
Chemical Property Profile of 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione
Property Insights of 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione
The XLogP value of 1.4595 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione. With a topological polar surface area (TPSA) of 54.45 Ų, 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione has 0 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 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione?
The CAS number of 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione is 339097-17-5.
What is the molecular formula of 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione?
The molecular formula of 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione is C11H10BrNO3S.
What is the molecular weight of 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione?
The molecular weight of 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione is 314.96 g/mol.
Where can I buy 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione?
You can request a quote for 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Bromophenyl)-2-methyl-1-oxo-1,4-thiazinane-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.