2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one
TL;DR: 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one (CAS 377053-53-7) is a chemical compound with molecular formula C16H14N2O2S and molecular weight 298.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-ethoxyanilino)-3,1-benzothiazin-4-one
Also Known As: 2-(4-ethoxyanilino)-3,1-benzothiazin-4-one, BAS 03181517, 2-(4-ethoxyanilino)-4H-3,1-benzothiazin-4-one, 2-(4-Ethoxy-phenylamino)-benzo[d][1,3]thiazin-4-one, 2-[(4-ethoxyphenyl)amino]-4H-3,1-benzothiazin-4-one
| Molecular Formula | C16H14N2O2S |
|---|---|
| Molecular Weight | 298.08 g/mol |
| LogP | 3.7988 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.0776 |
| Heavy Atoms | 21 |
| Complexity | 812.37 |
Chemical Identifiers
| CAS Number | 377053-53-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=O)S2 |
Product Overview
2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one (CAS 377053-53-7), with molecular formula C16H14N2O2S and molecular weight 298.08 g/mol. IUPAC: 2-(4-ethoxyanilino)-3,1-benzothiazin-4-one.
Chemical Property Profile of 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one
Property Insights of 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one
The XLogP value of 3.7988 indicates that 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one 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 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one?
The CAS number of 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one is 377053-53-7.
What is the molecular formula of 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one?
The molecular formula of 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one is C16H14N2O2S.
What is the molecular weight of 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one?
The molecular weight of 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one is 298.08 g/mol.
Where can I buy 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one?
You can request a quote for 2-(4-Ethoxyanilino)-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 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Ethoxyanilino)-3,1-benzothiazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.