2-Benzothiazolamine, 6-ethoxy-N-nitroso-
TL;DR: 2-Benzothiazolamine, 6-ethoxy-N-nitroso- (CAS 501935-65-5) is a chemical compound with molecular formula C9H9N3O2S and molecular weight 223.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-ethoxy-1,3-benzothiazol-2-yl)nitrous amide
Also Known As: 2-BENZOTHIAZOLAMINE, 6-ETHOXY-N-NITROSO-, 2-Benzothiazolamine, 6-ethoxy-N-nitroso- (9CI), N-(6-ethoxy-1,3-benzothiazol-2-yl)nitrous amide
| Molecular Formula | C9H9N3O2S |
|---|---|
| Molecular Weight | 223.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.04155 |
| Heavy Atoms | 15 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 501935-65-5 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)NN=O |
| InChIKey | YNJGUZRJUPXCGL-UHFFFAOYSA-N |
Product Overview
2-Benzothiazolamine, 6-ethoxy-N-nitroso- (CAS 501935-65-5), with molecular formula C9H9N3O2S and molecular weight 223.04 g/mol. IUPAC: N-(6-ethoxy-1,3-benzothiazol-2-yl)nitrous amide.
Chemical Property Profile of 2-Benzothiazolamine, 6-ethoxy-N-nitroso-
Property Insights of 2-Benzothiazolamine, 6-ethoxy-N-nitroso-
The XLogP value of 3.1 indicates that 2-Benzothiazolamine, 6-ethoxy-N-nitroso- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzothiazolamine, 6-ethoxy-N-nitroso-. Following Lipinski's Rule of Five, 2-Benzothiazolamine, 6-ethoxy-N-nitroso- has 1 hydrogen bond donor(s) and 6 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 2-Benzothiazolamine, 6-ethoxy-N-nitroso-?
The CAS number of 2-Benzothiazolamine, 6-ethoxy-N-nitroso- is 501935-65-5.
What is the molecular formula of 2-Benzothiazolamine, 6-ethoxy-N-nitroso-?
The molecular formula of 2-Benzothiazolamine, 6-ethoxy-N-nitroso- is C9H9N3O2S.
What is the molecular weight of 2-Benzothiazolamine, 6-ethoxy-N-nitroso-?
The molecular weight of 2-Benzothiazolamine, 6-ethoxy-N-nitroso- is 223.04 g/mol.
Where can I buy 2-Benzothiazolamine, 6-ethoxy-N-nitroso-?
You can request a quote for 2-Benzothiazolamine, 6-ethoxy-N-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzothiazolamine, 6-ethoxy-N-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzothiazolamine, 6-ethoxy-N-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.