![5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide structure](/static/products/532/5320-00-3.png)
5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide
TL;DR: 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide (CAS 5320-00-3) is a chemical compound with molecular formula C16H9N3O2S and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15λ6-thia-3,10,14-triazapentacyclo[11.6.1.02,11.04,9.016,20]icosa-1(20),2,4,6,8,10,12,16,18-nonaene 15,15-dioxide
Also Known As: CBChromo1_000288, 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide, 7H-[1,2]benzisothiazolo[4,3-ab]phenazine 4,4-dioxide, 5H-isothiazolo[3',4',5':4,5]naphtho[1,2-b]quinoxaline 4,4-dioxide
| Molecular Formula | C16H9N3O2S |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 307.04153 |
| Heavy Atoms | 22 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 5320-00-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3C=C4C5=C(C3=N2)C=CC=C5S(=O)(=O)N4 |
| InChIKey | LLUNQKDRHSUYCU-UHFFFAOYSA-N |
Product Overview
5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide (CAS 5320-00-3), with molecular formula C16H9N3O2S and molecular weight 307.04 g/mol. IUPAC: 15λ6-thia-3,10,14-triazapentacyclo[11.6.1.02,11.04,9.016,20]icosa-1(20),2,4,6,8,10,12,16,18-nonaene 15,15-dioxide.
Chemical Property Profile of 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide
Property Insights of 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide. Following Lipinski's Rule of Five, 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide 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 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide?
The CAS number of 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide is 5320-00-3.
What is the molecular formula of 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide?
The molecular formula of 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide is C16H9N3O2S.
What is the molecular weight of 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide?
The molecular weight of 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide is 307.04 g/mol.
Where can I buy 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide?
You can request a quote for 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 5H-[1,2]benzothiazolo[4,3-ab]phenazine 4,4-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.