S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate
TL;DR: S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate (CAS 40520-36-3) is a chemical compound with molecular formula C16H15N3O2S2 and molecular weight 345.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-acetamidoethyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate
Also Known As: S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate, 10H-Pyrido(3,2-b)(1,4)benzothiazine-10-carbothioic acid, S-(2-(acetylamino)ethyl) ester, s-[2-(acetylamino)ethyl] 10h-pyrido[3,2-b][1,4]benzothiazine-10-carbothioate, S-(2-acetamidoethyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate, N-{2-[(10H-Pyrido[3,2-b][1,4]benzothiazine-10-carbonyl)sulfanyl]ethyl}ethanimidic acid
| Molecular Formula | C16H15N3O2S2 |
|---|---|
| Molecular Weight | 345.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.06058 |
| Heavy Atoms | 23 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 40520-36-3 |
|---|---|
| SMILES | CC(=O)NCCSC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3 |
| InChIKey | QOEVWPSJLBFFFO-UHFFFAOYSA-N |
Product Overview
S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate (CAS 40520-36-3), with molecular formula C16H15N3O2S2 and molecular weight 345.06 g/mol. IUPAC: S-(2-acetamidoethyl) pyrido[3,2-b][1,4]benzothiazine-10-carbothioate.
Chemical Property Profile of S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate
Property Insights of S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate. Following Lipinski's Rule of Five, S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate 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 S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate?
The CAS number of S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate is 40520-36-3.
What is the molecular formula of S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate?
The molecular formula of S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate is C16H15N3O2S2.
What is the molecular weight of S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate?
The molecular weight of S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate is 345.06 g/mol.
Where can I buy S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate?
You can request a quote for S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-(Acetylamino)ethyl) 10H-pyrido(3,2-b)(1,4)benzothiazine-10-carbothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.