6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one
TL;DR: 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one (CAS 91472-13-8) is a chemical compound with molecular formula C10H9BrN2OS and molecular weight 283.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-(ethylamino)-3,1-benzothiazin-4-one
Also Known As: 6-bromo-2-(ethylamino)-3,1-benzothiazin-4-one, 6-Bromo-2-(ethylamino)-4H-3,1-benzothiazin-4-one
| Molecular Formula | C10H9BrN2OS |
|---|---|
| Molecular Weight | 283.96 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.9619 |
| Heavy Atoms | 15 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 91472-13-8 |
|---|---|
| SMILES | CCNC1=NC2=C(C=C(C=C2)Br)C(=O)S1 |
| InChIKey | DWNHKUSJVVSCTI-UHFFFAOYSA-N |
Product Overview
6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one (CAS 91472-13-8), with molecular formula C10H9BrN2OS and molecular weight 283.96 g/mol. IUPAC: 6-bromo-2-(ethylamino)-3,1-benzothiazin-4-one.
Chemical Property Profile of 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one
Property Insights of 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one. Following Lipinski's Rule of Five, 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one has 1 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 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one?
The CAS number of 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one is 91472-13-8.
What is the molecular formula of 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one?
The molecular formula of 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one is C10H9BrN2OS.
What is the molecular weight of 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one?
The molecular weight of 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one is 283.96 g/mol.
Where can I buy 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one?
You can request a quote for 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-2-(ethylamino)-3,1-benzothiazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.