![6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one structure](/static/products/100/100441-17-6.png)
6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one
TL;DR: 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one (CAS 100441-17-6) is a chemical compound with molecular formula C22H11N3O3S2 and molecular weight 429.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1,3-benzothiazol-2-yl)-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-5-one
Also Known As: 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one, 6-(1,3-benzothiazol-2-yl)-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-5-one, 6-(1,3-benzothiazol-2-yl)-3-nitro-5H-[1,3]benzothiazolo[3,2-a]quinolin-5-one
| Molecular Formula | C22H11N3O3S2 |
|---|---|
| Molecular Weight | 429.02 g/mol |
| LogP | 5.8523 |
| Topological Polar Surface Area | 77.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 429.02417 |
| Heavy Atoms | 30 |
| Complexity | 1678.9556 |
Chemical Identifiers
| CAS Number | 100441-17-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=C4N(C5=C(C3=O)C=C(C=C5)[N+](=O)[O-])C6=CC=CC=C6S4 |
Product Overview
6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one (CAS 100441-17-6), with molecular formula C22H11N3O3S2 and molecular weight 429.02 g/mol. IUPAC: 6-(1,3-benzothiazol-2-yl)-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-5-one.
Chemical Property Profile of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one
Property Insights of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one
The XLogP value of 5.8523 indicates that 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one. Following Lipinski's Rule of Five, 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one?
The CAS number of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one is 100441-17-6.
What is the molecular formula of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one?
The molecular formula of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one is C22H11N3O3S2.
What is the molecular weight of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one?
The molecular weight of 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one is 429.02 g/mol.
Where can I buy 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one?
You can request a quote for 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(benzo[d]thiazol-2-yl)-3-nitro-5H-benzo[4,5]thiazolo[3,2-a]quinolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.