5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate
TL;DR: 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate (CAS 361468-65-7) is a chemical compound with molecular formula C14H14BrNO4S and molecular weight 370.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-bromo-2-oxo-1,3-benzoxathiol-6-yl) N-cyclohexylcarbamate
Also Known As: 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate, (5-bromo-2-oxo-1,3-benzoxathiol-6-yl) N-cyclohexylcarbamate, 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate #, 5-Bromo-2-oxo-2H-1,3-benzoxathiol-6-yl cyclohexylcarbamate, 5-bromo-2-oxobenzo[d][1,3]oxathiol-6-yl cyclohexylcarbamate
| Molecular Formula | C14H14BrNO4S |
|---|---|
| Molecular Weight | 370.98 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 370.9827 |
| Heavy Atoms | 21 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 361468-65-7 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)OC2=C(C=C3C(=C2)OC(=O)S3)Br |
| InChIKey | JXLPRCXUTYCISR-UHFFFAOYSA-N |
Product Overview
5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate (CAS 361468-65-7), with molecular formula C14H14BrNO4S and molecular weight 370.98 g/mol. IUPAC: (5-bromo-2-oxo-1,3-benzoxathiol-6-yl) N-cyclohexylcarbamate.
Chemical Property Profile of 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate
Property Insights of 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate
The XLogP value of 4.3 indicates that 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate. Following Lipinski's Rule of Five, 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate 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 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate?
The CAS number of 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate is 361468-65-7.
What is the molecular formula of 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate?
The molecular formula of 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate is C14H14BrNO4S.
What is the molecular weight of 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate?
The molecular weight of 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate is 370.98 g/mol.
Where can I buy 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate?
You can request a quote for 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-oxo-1,3-benzoxathiol-6-yl cyclohexylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.