2-(Methoxyacetylamino)-6-nitrobenzothiazole
TL;DR: 2-(Methoxyacetylamino)-6-nitrobenzothiazole (CAS 133024-57-4) is a chemical compound with molecular formula C10H9N3O4S and molecular weight 267.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
Also Known As: 2-(methoxyacetylamino)-6-nitrobenzothiazole, BAS 07311457, 2-methoxy-N-(6-nitrobenzothiazol-2-yl)acetamide, 2-methoxy-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide, AS-871/40991218
| Molecular Formula | C10H9N3O4S |
|---|---|
| Molecular Weight | 267.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.03137 |
| Heavy Atoms | 18 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 133024-57-4 |
|---|---|
| SMILES | COCC(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-] |
| InChIKey | IMLZKWSEXPUPJJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Methoxyacetylamino)-6-nitrobenzothiazole (CAS 133024-57-4), with molecular formula C10H9N3O4S and molecular weight 267.03 g/mol. IUPAC: 2-methoxy-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide.
Chemical Property Profile of 2-(Methoxyacetylamino)-6-nitrobenzothiazole
Property Insights of 2-(Methoxyacetylamino)-6-nitrobenzothiazole
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methoxyacetylamino)-6-nitrobenzothiazole. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methoxyacetylamino)-6-nitrobenzothiazole. Following Lipinski's Rule of Five, 2-(Methoxyacetylamino)-6-nitrobenzothiazole 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-(Methoxyacetylamino)-6-nitrobenzothiazole?
The CAS number of 2-(Methoxyacetylamino)-6-nitrobenzothiazole is 133024-57-4.
What is the molecular formula of 2-(Methoxyacetylamino)-6-nitrobenzothiazole?
The molecular formula of 2-(Methoxyacetylamino)-6-nitrobenzothiazole is C10H9N3O4S.
What is the molecular weight of 2-(Methoxyacetylamino)-6-nitrobenzothiazole?
The molecular weight of 2-(Methoxyacetylamino)-6-nitrobenzothiazole is 267.03 g/mol.
Where can I buy 2-(Methoxyacetylamino)-6-nitrobenzothiazole?
You can request a quote for 2-(Methoxyacetylamino)-6-nitrobenzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methoxyacetylamino)-6-nitrobenzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methoxyacetylamino)-6-nitrobenzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.