3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide
TL;DR: 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide (CAS 53983-79-2) is a chemical compound with molecular formula C10H11NO3S and molecular weight 225.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propan-2-yloxy-1,2-benzothiazole 1,1-dioxide
Also Known As: BAS 12679436, 3-(propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide, 3-Isopropoxy-benzo[d]isothiazole 1,1-dioxide, 3-propan-2-yloxy-1,2-benzothiazole 1,1-dioxide
| Molecular Formula | C10H11NO3S |
|---|---|
| Molecular Weight | 225.05 g/mol |
| LogP | 1.5605 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.04596 |
| Heavy Atoms | 15 |
| Complexity | 517.22394 |
Chemical Identifiers
| CAS Number | 53983-79-2 |
|---|---|
| SMILES | CC(C)OC1=NS(=O)(=O)C2=CC=CC=C21 |
Product Overview
3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide (CAS 53983-79-2), with molecular formula C10H11NO3S and molecular weight 225.05 g/mol. IUPAC: 3-propan-2-yloxy-1,2-benzothiazole 1,1-dioxide.
Chemical Property Profile of 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide
Property Insights of 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide
The XLogP value of 1.5605 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide. With a topological polar surface area (TPSA) of 55.73 Ų, 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide 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 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide?
The CAS number of 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide is 53983-79-2.
What is the molecular formula of 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide?
The molecular formula of 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide is C10H11NO3S.
What is the molecular weight of 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide?
The molecular weight of 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide is 225.05 g/mol.
Where can I buy 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide?
You can request a quote for 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Propan-2-yloxy)-1,2-benzothiazole 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.